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9H-Fluoren-2-ol-d9 (NSC 31248-d9)

Cat No.:V65108 Purity: ≥98%
9H-Fluoren-2-ol-d9 (NSC 31248-d9) is a deuterated active compound.
9H-Fluoren-2-ol-d9 (NSC 31248-d9)
9H-Fluoren-2-ol-d9 (NSC 31248-d9) Chemical Structure CAS No.: 922510-18-7
Product category: Isotope-Labeled Compounds
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
Other Sizes
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Product Description
9H-Fluoren-2-ol-d9 (NSC 31248-d9) is a deuterated active compound.
9H-Fluoren-2-ol-d9 (NSC 31248-d9) is a stable isotope-labeled compound where all nine hydrogen atoms on the fluorene core are replaced by deuterium. This compound is specifically designed for use as a surrogate internal standard in quantitative analytical workflows, enabling precise calibration and matrix effect correction in mass spectrometry.
Biological Activity I Assay Protocols (From Reference)
Targets
9H-Fluoren-2-ol-d9 does not interact with a specific biological target. It is an analytical standard used solely for quantification purposes, with the deuterium label enabling mass discrimination in LC-MS/MS and GC-MS assays against the non-deuterated analyte 9H-Fluoren-2-ol.
ln Vitro
Drug compounds have included stable heavy isotopes of carbon, hydrogen, and other elements, mostly as tracers that influence measurement during the drug development process. It's possible that the pharmacokinetics and functional range of medications contribute to the concern over mutagenesis [1].
This deuterated standard exhibits no inherent biological or pharmacological activity. Its analytical activity is defined by its performance in mass spectrometry, where it perfectly co-elutes with the target analyte and provides a distinct mass shift (+9 Da) for accurate peak integration and quantification in complex biological matrices.
ln Vivo
There is no in vivo activity for this compound, as it is a stable isotope-labeled internal standard not intended for systemic administration. It is employed ex vivo as a quality control tool in method validation and bioanalysis of biological samples for environmental or biomedical research.
Enzyme Assay
As a reference standard, 9H-Fluoren-2-ol-d9 is not used in enzyme/receptor binding assays. For analytical use, stock solutions are prepared in an appropriate solvent such as methanol or acetonitrile, and diluted with matched matrix to prepare a calibration curve. The compound is injected into GC-MS or LC-MS, monitoring the mass transitions of both the labeled and unlabeled analyte.
Cell Assay
This compound is not used in cell-based experiments. It serves as an internal standard for the quantification of 9H-Fluoren-2-ol in complex biological fluids such as plasma, urine, or tissue homogenates. Quality control samples containing the internal standard are analyzed in parallel with study samples to ensure batch-to-batch consistency.
Animal Protocol
There is no animal protocol for the labeled standard itself. In typical bioanalytical studies, animals are dosed with the unlabeled compound (e.g., 9H-Fluoren-2-ol), and plasma or tissue samples are collected. The stable isotope-labeled internal standard is then added to these samples during sample preparation prior to instrumental analysis to quantify the test compound.
ADME/Pharmacokinetics
PK properties are not applicable for this labeled standard, as it is not administered in vivo. However, when used as an internal standard in PK studies of 9H-Fluoren-2-ol, it is typically formulated in organic solvents (e.g., methanol, acetonitrile, or DMSO) at ug/mL concentrations and added to biological samples during workup.
Toxicity/Toxicokinetics
As a stable isotope-labeled analytical standard, 9H-Fluoren-2-ol-d9 is considered a low-toxicity chemical reagent. Standard safety precautions for handling organic solvents apply. The compound is not intended for human or animal use and is for research purposes only.
References

[1]. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-246.

Additional Infomation
9H-Fluoren-2-ol-d9 is a deuterium-labeled analog of the aromatic compound NSC 31248. It is produced under ISO 17034 accredited quality systems, ensuring high purity and certified concentration. Stable heavy isotope-labeled compounds like this are extensively employed as tracers for quantitation during the drug development process and for method validation by regulatory agencies.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C13HD9O
Molecular Weight
191.27
Exact Mass
191.13
CAS #
922510-18-7
PubChem CID
46781810
Appearance
Typically exists as solid at room temperature
Density
1.303g/cm3
Boiling Point
372.079ºC at 760 mmHg
Flash Point
182.013ºC
Index of Refraction
1.683
LogP
2.963
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Heavy Atom Count
14
Complexity
213
Defined Atom Stereocenter Count
0
SMILES
c1ccc-2c(c1)Cc3c2ccc(c3)O
InChi Key
ZDOIAPGLORMKTR-MFNUZUOVSA-N
InChi Code
InChI=1S/C13H10O/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8,14H,7H2/i1D,2D,3D,4D,5D,6D,7D2,8D
Chemical Name
1,3,4,5,6,7,8,9,9-nonadeuteriofluoren-2-ol
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 5.2282 mL 26.1411 mL 52.2821 mL
5 mM 1.0456 mL 5.2282 mL 10.4564 mL
10 mM 0.5228 mL 2.6141 mL 5.2282 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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