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Cyclohexanesulfenyl chloride

HCID 87312
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
17797-03-4
Standard SMILES
ClSC1CCCCC1
InChIKey
XRFDWTWFFLOKAV-UHFFFAOYSA-N
Molecular formula
C6H11ClS
Average molar mass
150.67 g/mol
Monoisotopic mass
150.0269992

Names & identifiers

Preferred name
Cyclohexanesulfenyl chloride
IUPAC
cyclohexyl thiohypochlorite
English name
Cyclohexanesulfenyl chloride
Molecular formula
C6H11ClS
Molecular weight
150.67

Names & synonyms

Cyclohexanesulfenyl chloridecyclohexyl thiohypochlorite17797-03-47R56E4G5AM(CHLOROSULFANYL)CYCLOHEXANEDTXSID3027794CYCLOHEXYLSULFENYL CHLORIDERefChem:129606DTXCID407794cyclohexyl chlorosulfidecyclohexylsulphenyl chlorideUNII-7R56E4G5AM
Show more names
SCHEMBL5334405

Database identifiers

CAS
17797-03-4
PubChem CID
87312
DTXSID
DTXSID3027794
UNII
7R56E4G5AM
Nikkaji
J23.478H

Properties

Computed structural propertiesFilling in

XLogP
3.1
Topological polar surface area
25.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
59.5

Physicochemical properties

FDA UNII
7 R56E4G5AM · 7R56E4G5AM
EPA Substance Registry System
Cyclohexanesulfenyl chloride (17797-03-4)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationCyclohexanesulfenyl chloride: INACTIVE

Upstream & downstream products

Downstream products

Cyclohexylthiophthalimide

Related reactions

7 records
New reaction record
HRID 543707 reaction equation
HRID 543707As reactantuspto-grants-1984_05
HRID 648077 reaction equation
HRID 648077As reactantuspto-grants-1983_10
HRID 648078 reaction equation
HRID 648078As reactantuspto-grants-1983_10
HRID 1076147 reaction equation
HRID 1076147As reactantuspto-grants-1976_05
HRID 1233245 reaction equation
HRID 1233245As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1658182 reaction equation
HRID 1658182As reactantuspto-grants-1976_06
HRID 1658183 reaction equation
HRID 1658183As reactantuspto-grants-1976_06

Compound notes

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