Cyclohexanethiol, 1-methyl-4-(1-methylethenyl)-
Basic information
- CAS
68921-82-4- Standard SMILES
C=C(C)C1CCC(C)(S)CC1- InChIKey
NNHMUEBTWCOFED-UHFFFAOYSA-N- Molecular formula
- C10H18S
- Average molar mass
- 170.32 g/mol
- Monoisotopic mass
- 170.11292175
Names & identifiers
- Preferred name
- Cyclohexanethiol, 1-methyl-4-(1-methylethenyl)-
- IUPAC
- 1-methyl-4-prop-1-en-2-ylcyclohexane-1-thiol
- English name
- 1-methyl-4-(1-methylvinyl)cyclohexanethiol
- Molecular formula
- C10H18S
- Molecular weight
- 170.31492
Names & synonyms
68921-82-4Cyclohexanethiol, 1-methyl-4-(1-methylethenyl)-EINECS 272-963-7DTXSID9071840RefChem:580618DTXCID80463271-Methyl-4-(1-methylvinyl)cyclohexanethiolSCHEMBL24421017SCHEMBL297886401-METHYL-4-(PROP-1-EN-2-YL)CYCLOHEXANE-1-THIOLNNHMUEBTWCOFED-UHFFFAOYSA-NNS00036753
Show more names
1-Mercapto-p-mentha-8-ene1-Methyl-4-(1-methylethenyl)cyclohexanethiol
Database identifiers
- CAS
68921-82-4- PubChem CID
- 111429
- DTXSID
DTXSID9071840- EC Number
- 272-963-7
- Nikkaji
- J310.538E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 152
Physicochemical properties
- EPA Substance Registry System
- 1 · Cyclohexanethiol, 1-methyl-4-(1-methylethenyl)- (68921-82-4)
- 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 InformationCyclohexanethiol, 1-methyl-4-(1-methylethenyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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