Ethanamine, 2-(butylthio)-
Basic information
- CAS
3581-01-9- Standard SMILES
CCCCSCCN- InChIKey
PQKHJKIUTWBNGR-UHFFFAOYSA-N- Molecular formula
- C6H15NS
- Average molar mass
- 133.26 g/mol
- Monoisotopic mass
- 133.09252066
Names & identifiers
- Preferred name
- Ethanamine, 2-(butylthio)-
- IUPAC
- 2-butylsulfanylethanamine
- English name
- 2-(butylthio)ethanamine
- Molecular formula
- C6H15NS
- Molecular weight
- 0
Names & synonyms
3581-01-92-(Butylthio)ethanamine hydrochloride2-butylthioethylamineEthanamine, 2-(butylthio)-2-(butylthio)ethanamine2-(butylsulfanyl)ethan-1-amineNSC194880SCHEMBL5242871SCHEMBL5932755DTXSID60307744ALBB-025732SBB072659
Show more names
UKRORGSYN-BB BBV-065295
AKOS000175305NSC-194880ST45028839
Database identifiers
- CAS
3581-01-9- PubChem CID
- 304044
- DTXSID
DTXSID60307744- Nikkaji
- J341.517A
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 39.5
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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