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Isotope-labelled compounds

Cyclohexanecarboxylic-D11 acid

Also known as Cyclohexanecarboxylic acid-d11, 1,2,2,3,3,4,4,5,5,6,6-Undecadeuteriocyclohexane-1-carboxylic acid, Cyclohexane-1,2,2,3,3,4,4,5,5,6,6-d11-carboxylic Acid

CAS 93131-16-9Formula C7H12O2Molar mass 139.24 g/mol
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Cyclohexanecarboxylic-D11 acid chemical structure, C7H12O2, CAS 93131-16-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
93131-16-9
Formula
C7H12O2
Molar mass
139.24 g/mol
HS code
284590
Category
Isotope-labelled compounds

What is Cyclohexanecarboxylic-D11 acid?

Plain description, key identifiers and synonyms

Cyclohexanecarboxylic-D11 acid is a chemical substance with the molecular formula C7H12O2 and a molar mass of 139.24 g/mol. Its CAS registry number is 93131-16-9. The IUPAC name is 1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexane-1-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexane-1-carboxylic acid
CAS number
93131-16-9
Molecular formula
C7H12O2
InChIKey
NZNMSOFKMUBTKW-KAFHOZLVSA-N
InChI
InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)/i1D2,2D2,3D2,4D2,5D2,6D
Canonical SMILES
O=C(O)C1CCCCC1
Isomeric SMILES
[2H]C1(C(C(C(C(C1([2H])[2H])([2H])[2H])([2H])C(=O)O)([2H])[2H])([2H])[2H])[2H]

Synonyms

  • Cyclohexanecarboxylic acid-d11
  • 1,2,2,3,3,4,4,5,5,6,6-Undecadeuteriocyclohexane-1-carboxylic acid
  • Cyclohexane-1,2,2,3,3,4,4,5,5,6,6-d11-carboxylic Acid
  • (?H??)cyclohexane-1-carboxylic acid
  • 1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexanecarboxylic acid

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
139.24 g/molcalc.
Exact mass
139.1528 Dacalc.
LogP (octanol/water)
1.65calc.
Topological polar surface area
37.3 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
1calc.
Heavy atoms
9calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.86calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, C1CCCCC1

C1CCCCC1

1 ring, 6 atoms, the Cyclohexane ring system.

24,737 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Cyclohexanecarboxylic-D11 acid suppliers

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Cyclohexanecarboxylic-D11 acid price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Cyclohexanecarboxylic-D11 acid is traded under.

HS 2845.90Indicative HS code

Compounds, inorganic or organic, of such isotopes, whether or not chemically defined

World exports in 2024
$2.67B
+19.0% vs 2023, imports $1.67B
2019 to 2024
Top exporters
  1. Ireland55.3%
  2. Hong Kong11.8%
  3. United States10.7%
Top importers
  1. China24.3%
  2. Ireland21.9%
  3. South Korea13.3%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Cyclohexanecarboxylic-D11 acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cyclohexanecarboxylic-D11 acid, based on the data on this page

What is Cyclohexanecarboxylic-D11 acid?

Cyclohexanecarboxylic-D11 acid is a chemical substance with the molecular formula C7H12O2 and a molar mass of 139.24 g/mol. Its CAS registry number is 93131-16-9. The IUPAC name is 1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexane-1-carboxylic acid.

What is the CAS number of Cyclohexanecarboxylic-D11 acid?

The CAS registry number of Cyclohexanecarboxylic-D11 acid is 93131-16-9.

What is the molecular formula and weight of Cyclohexanecarboxylic-D11 acid?

The molecular formula of Cyclohexanecarboxylic-D11 acid is C7H12O2 and its molar mass is 139.24 g/mol.

What is Cyclohexanecarboxylic-D11 acid used for?

Known uses and roles of Cyclohexanecarboxylic-D11 acid include isotope-labelled compounds in research and laboratory.

Is Cyclohexanecarboxylic-D11 acid hazardous?

No GHS hazard classification for Cyclohexanecarboxylic-D11 acid is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Cyclohexanecarboxylic-D11 acid?

Cyclohexanecarboxylic-D11 acid is usually classified under HS code 284590 (Isotopes other than those of heading 2844, compounds, inorganic or organic, of such…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cyclohexanecarboxylic-D11 acid?

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What is the price of Cyclohexanecarboxylic-D11 acid?

Suppliers quote Cyclohexanecarboxylic-D11 acid on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Cyclohexanecarboxylic-D11 acid

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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