S-Ethyl prop-2-en-1-ylcarbamothioate
Basic information
- CAS
39078-66-5- Standard SMILES
C=CCNC(=O)SCC- InChIKey
ZTJKADSGFILDSU-UHFFFAOYSA-N- Molecular formula
- C6H11NOS
- Average molar mass
- 145.23 g/mol
- Monoisotopic mass
- 145.05613515
Names & identifiers
- Preferred name
- S-Ethyl prop-2-en-1-ylcarbamothioate
- IUPAC
- S-ethyl N-prop-2-enylcarbamothioate
Names & synonyms
39078-66-5NSC357598S-Ethyl prop-2-en-1-ylcarbamothioateSCHEMBL23072475DTXSID30320309AKOS006356315NSC-357598
Database identifiers
- CAS
39078-66-5- PubChem CID
- 337841
- DTXSID
DTXSID30320309
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 103
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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