O-Butan-2-YL methyl(2-phenylethyl)carbamothioate
Basic information
- CAS
93359-43-4- Standard SMILES
CCC(C)OC(=S)N(C)CCc1ccccc1- InChIKey
HCGLPXZOALEIHG-UHFFFAOYSA-N- Molecular formula
- C14H21NOS
- Average molar mass
- 251.39 g/mol
- Monoisotopic mass
- 251.13438547
Names & identifiers
- Preferred name
- O-Butan-2-YL methyl(2-phenylethyl)carbamothioate
- IUPAC
- O-butan-2-yl N-methyl-N-(2-phenylethyl)carbamothioate
Names & synonyms
93359-43-4O-BUTAN-2-YL METHYL(2-PHENYLETHYL)CARBAMOTHIOATEDTXSID40918493O-(Butan-2-yl) methyl(2-phenylethyl)carbamothioateCarbamothioic acid, methyl(2-phenylpentyl)-, S-butyl ester
Database identifiers
- CAS
93359-43-4- PubChem CID
- 185253
- DTXSID
DTXSID40918493
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 226
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…