Basic information
- CAS
4706-22-3- Standard SMILES
SCCN1CCCCC1- InChIKey
LXNAJQBFIIYIIS-UHFFFAOYSA-N- Molecular formula
- C7H15NS
- Average molar mass
- 145.27 g/mol
- Monoisotopic mass
- 145.09252066
Names & identifiers
- Preferred name
- Ethanethiol, 2-piperidino-
- IUPAC
- 2-piperidin-1-ylethanethiol
Names & synonyms
Ethanethiol, 2-piperidino-2-Piperidinoethanethiol1-Piperidineethanethiol2-(1-Piperidinyl)ethanethiolN-(2-Mercaptoethyl)piperidineN-PiperidylcysteaminN-Piperidylcysteamin [German]1-(2-Mercaptoethyl)piperidineBRN 0103420DTXSID301970135-20-02-00148 (Beilstein Handbook Reference)RefChem:340570
Show more names
1-Piperidineethanethiol (9CI)DTXCID40119504Piperidine, 1-mercaptoethyl-4706-22-32-(PIPERIDIN-1-YL)ETHANE-1-THIOL2-piperidin-1-ylethanethiol2-piperidylethane-1-thiol2-(N-Piperidinyl)ethanethiol
Database identifiers
- CAS
4706-22-3- PubChem CID
- 78434
- DTXSID
DTXSID30197013- Nikkaji
- J49.794K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 4.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 69.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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