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Aldehydes and ketones

Cyclohexanecarbothioamide, 2-oxo-

Also known as 2-oxocyclohexane-1-carbothioamide

CAS 51978-91-7Formula C7H11NOSMolar mass 157.24 g/mol
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Cyclohexanecarbothioamide, 2-oxo- chemical structure, C7H11NOS, CAS 51978-91-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
51978-91-7
Formula
C7H11NOS
Molar mass
157.24 g/mol
HS code
293090
Category
Aldehydes and ketones

What is Cyclohexanecarbothioamide, 2-oxo-?

Plain description, key identifiers and synonyms

Cyclohexanecarbothioamide, 2-oxo- is a chemical substance with the molecular formula C7H11NOS and a molar mass of 157.24 g/mol. Its CAS registry number is 51978-91-7. The IUPAC name is 2-oxocyclohexane-1-carbothioamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-oxocyclohexane-1-carbothioamide
CAS number
51978-91-7 CAS number cross-checked
Molecular formula
C7H11NOS
InChIKey
XPJZIZBQAIFVSZ-UHFFFAOYSA-N
InChI
InChI=1S/C7H11NOS/c8-7(10)5-3-1-2-4-6(5)9/h5H,1-4H2,(H2,8,10)
SMILES (canonical and isomeric)
C1CCC(=O)C(C1)C(=S)N

Synonyms

  • 2-oxocyclohexane-1-carbothioamide

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
157.24 g/molcalc.
Exact mass
157.0561 Dacalc.
LogP (octanol/water)
1.03calc.
Topological polar surface area
43.09 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
1calc.
Heavy atoms
10calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.71calc.
Formal charge
0calc.
Stereocentres
1calc.
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, O=C1CCCCC1

O=C1CCCCC1

1 ring, 7 atoms, the Cyclohexanone ring system.

2,698 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.

Cyclohexanecarbothioamide, 2-oxo- suppliers

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Cyclohexanecarbothioamide, 2-oxo- 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 Cyclohexanecarbothioamide, 2-oxo- is traded under.

HS 2930.90Indicative HS code

Organo-sulphur compounds, other

World exports in 2024
$5.83B
+0.1% vs 2023, imports $5.93B
2019 to 2024
Top exporters
  1. China40.7%
  2. United States10.9%
  3. Japan9.3%
Top importers
  1. United States13.3%
  2. Brazil12.6%
  3. China6.6%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Cyclohexanecarbothioamide, 2-oxo- is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cyclohexanecarbothioamide, 2-oxo-, based on the data on this page

What is Cyclohexanecarbothioamide, 2-oxo-?

Cyclohexanecarbothioamide, 2-oxo- is a chemical substance with the molecular formula C7H11NOS and a molar mass of 157.24 g/mol. Its CAS registry number is 51978-91-7. The IUPAC name is 2-oxocyclohexane-1-carbothioamide.

What is the CAS number of Cyclohexanecarbothioamide, 2-oxo-?

The CAS registry number of Cyclohexanecarbothioamide, 2-oxo- is 51978-91-7.

What is the molecular formula and weight of Cyclohexanecarbothioamide, 2-oxo-?

The molecular formula of Cyclohexanecarbothioamide, 2-oxo- is C7H11NOS and its molar mass is 157.24 g/mol.

What is Cyclohexanecarbothioamide, 2-oxo- used for?

Known uses and roles of Cyclohexanecarbothioamide, 2-oxo- include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Cyclohexanecarbothioamide, 2-oxo- hazardous?

No GHS hazard classification for Cyclohexanecarbothioamide, 2-oxo- 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 Cyclohexanecarbothioamide, 2-oxo-?

Cyclohexanecarbothioamide, 2-oxo- is usually classified under HS code 293090 (Organo-sulphur compounds, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cyclohexanecarbothioamide, 2-oxo-?

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What is the price of Cyclohexanecarbothioamide, 2-oxo-?

Suppliers quote Cyclohexanecarbothioamide, 2-oxo- 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 Cyclohexanecarbothioamide, 2-oxo-

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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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