Ethanethiol, 2-cinnamylamino-, (E)-
Basic information
- CAS
75606-32-5- Standard SMILES
SCCNC/C=C/c1ccccc1- InChIKey
UMWMNEZXCLULBG-QPJJXVBHSA-N- Molecular formula
- C11H15NS
- Average molar mass
- 193.31 g/mol
- Monoisotopic mass
- 193.09252066
Names & identifiers
- Preferred name
- Ethanethiol, 2-cinnamylamino-, (E)-
- IUPAC
- 2-[[(E)-3-phenylprop-2-enyl]amino]ethanethiol
Names & synonyms
Ethanethiol, 2-cinnamylamino-, (E)-75606-32-5RefChem:1084395trans-2-CinnamylaminoethanethiolBRN 5499546
Database identifiers
- CAS
75606-32-5- PubChem CID
- 6447461
- Nikkaji
- J77.489H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 13 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 139
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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