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Aromatic building blocks

S-(2-Nitrophenyl) cyclohexanecarbothioate

CAS 65842-48-0Formula C13H15NO3SMolar mass 265.33 g/mol
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S-(2-Nitrophenyl) cyclohexanecarbothioate chemical structure, C13H15NO3S, CAS 65842-48-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
65842-48-0
Formula
C13H15NO3S
Molar mass
265.33 g/mol
HS code
293090
Category
Aromatic building blocks

What is S-(2-Nitrophenyl) cyclohexanecarbothioate?

Plain description, key identifiers and synonyms

S-(2-Nitrophenyl) cyclohexanecarbothioate is a chemical substance with the molecular formula C13H15NO3S and a molar mass of 265.33 g/mol. Its CAS registry number is 65842-48-0.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
S-(2-nitrophenyl) cyclohexanecarbothioate
CAS number
65842-48-0 CAS number cross-checked
Molecular formula
C13H15NO3S
InChIKey
MWEKJMGBYMGJEI-UHFFFAOYSA-N
InChI
InChI=1S/C13H15NO3S/c15-13(10-6-2-1-3-7-10)18-12-9-5-4-8-11(12)14(16)17/h4-5,8-10H,1-3,6-7H2
SMILES (canonical and isomeric)
C1CCC(CC1)C(=O)SC2=CC=CC=C2[N+](=O)[O-]

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
265.33 g/molcalc.
Exact mass
265.0773 Dacalc.
LogP (octanol/water)
3.79calc.
Topological polar surface area
60.21 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
18calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.46calc.
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, O=C(Sc1ccccc1)C1CCCCC1

O=C(Sc1ccccc1)C1CCCCC1

2 rings, 15 atoms, the S-Phenyl cyclohexanecarbothioate ring system.

1 other chemical 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.

S-(2-Nitrophenyl) cyclohexanecarbothioate suppliers

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S-(2-Nitrophenyl) cyclohexanecarbothioate price

Indicative price range per kg from live supplier offers

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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 S-(2-Nitrophenyl) cyclohexanecarbothioate 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 S-(2-Nitrophenyl) cyclohexanecarbothioate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about S-(2-Nitrophenyl) cyclohexanecarbothioate, based on the data on this page

What is S-(2-Nitrophenyl) cyclohexanecarbothioate?

S-(2-Nitrophenyl) cyclohexanecarbothioate is a chemical substance with the molecular formula C13H15NO3S and a molar mass of 265.33 g/mol. Its CAS registry number is 65842-48-0.

What is the CAS number of S-(2-Nitrophenyl) cyclohexanecarbothioate?

The CAS registry number of S-(2-Nitrophenyl) cyclohexanecarbothioate is 65842-48-0.

What is the molecular formula and weight of S-(2-Nitrophenyl) cyclohexanecarbothioate?

The molecular formula of S-(2-Nitrophenyl) cyclohexanecarbothioate is C13H15NO3S and its molar mass is 265.33 g/mol.

What is S-(2-Nitrophenyl) cyclohexanecarbothioate used for?

Known uses and roles of S-(2-Nitrophenyl) cyclohexanecarbothioate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is S-(2-Nitrophenyl) cyclohexanecarbothioate hazardous?

No GHS hazard classification for S-(2-Nitrophenyl) cyclohexanecarbothioate 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 S-(2-Nitrophenyl) cyclohexanecarbothioate?

S-(2-Nitrophenyl) cyclohexanecarbothioate 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 S-(2-Nitrophenyl) cyclohexanecarbothioate?

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What is the price of S-(2-Nitrophenyl) cyclohexanecarbothioate?

Suppliers quote S-(2-Nitrophenyl) cyclohexanecarbothioate 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 S-(2-Nitrophenyl) cyclohexanecarbothioate

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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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