Basic information
- CAS
408-09-3- Standard SMILES
FCCCCCCS- InChIKey
YEJIOOCWBINOSK-UHFFFAOYSA-N- Molecular formula
- C6H13FS
- Average molar mass
- 136.23 g/mol
- Monoisotopic mass
- 136.07219975
Names & identifiers
- Preferred name
- Hexanethiol, 6-fluoro-
- IUPAC
- 6-fluorohexane-1-thiol
- English name
- 6-Fluoro-1-hexanethiol
- Molecular formula
- C6H13FS
- Molecular weight
- 136.23
Names & synonyms
HEXANETHIOL, 6-FLUORO-408-09-36-Fluorohexyl mercaptanMercaptan, 6-fluorohexyl-BRN 1732504DTXSID601937854-01-00-01707 (Beilstein Handbook Reference)RefChem:347646DTXCID001162766-fluorohexane-1-thiolSCHEMBL516590SCHEMBL516591
Show more names
6-Fluoro-1-hexanethiol1-Hexanethiol, 6-fluoro-
Database identifiers
- CAS
408-09-3- PubChem CID
- 9853
- DTXSID
DTXSID60193785- Nikkaji
- J49.405D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 39.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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