propanoic acid, 3-(ethylthio)-, ammonium salt
Basic information
- CAS
137882-39-4- Standard SMILES
CCSCCC(=O)[O-].[NH4+]- InChIKey
NVVQOJGLIUSESF-UHFFFAOYSA-N- Molecular formula
- C5H13NO2S
- Average molar mass
- 151.23 g/mol
- Monoisotopic mass
- 151.06669983
Names & identifiers
- Preferred name
- propanoic acid, 3-(ethylthio)-, ammonium salt
- IUPAC
- azanium 3-ethylsulfanylpropanoate
Names & synonyms
Ammonium 3-(ethylthio)propanoateAmmonium ethylthiopropionate137882-39-4Propanoic acid, 3-(ethylthio)-, ammonium saltDTXSID80160358RefChem:374825DTXCID7082849AMMONIUM 3-(ETHYLSULFANYL)PROPANOATE
Database identifiers
- CAS
137882-39-4- PubChem CID
- 3071609
- DTXSID
DTXSID80160358
Properties
Computed structural properties
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 67.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…