s-Ethyl octadecylcarbamothioate
Basic information
- CAS
6961-65-5- Standard SMILES
CCCCCCCCCCCCCCCCCCNC(=O)SCC- InChIKey
SYSKNXQEMYEEEE-UHFFFAOYSA-N- Molecular formula
- C21H43NOS
- Average molar mass
- 357.6 g/mol
- Monoisotopic mass
- 357.30653617
Names & identifiers
- Preferred name
- s-Ethyl octadecylcarbamothioate
- IUPAC
- S-ethyl N-octadecylcarbamothioate
Names & synonyms
6961-65-5s-ethyl octadecylcarbamothioateNSC62740NCIOpen2_008282DTXSID10289682NSC-62740
Database identifiers
- CAS
6961-65-5- PubChem CID
- 247684
- DTXSID
DTXSID10289682
Properties
Computed structural properties
- XLogP
- 9.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 19
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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