Basic information
- CAS
586968-30-1- Standard SMILES
CCOC(=O)N(C)CCC(=O)c1cccs1- InChIKey
PMCHPRVLJHYZPF-UHFFFAOYSA-N- Molecular formula
- C11H15NO3S
- Average molar mass
- 241.31 g/mol
- Monoisotopic mass
- 241.07726451
Names & identifiers
- Preferred name
- Carbamic acid, methyl[3-oxo-3-(2-thienyl)propyl]-, ethyl ester
- IUPAC
- ethyl N-methyl-N-(3-oxo-3-thiophen-2-ylpropyl)carbamate
Names & synonyms
586968-30-1Carbamic acid, methyl[3-oxo-3-(2-thienyl)propyl]-, ethyl esterDTXSID00435717Ethyl methyl[3-oxo-3-(thiophen-2-yl)propyl]carbamate
Database identifiers
- CAS
586968-30-1- PubChem CID
- 10105751
- DTXSID
DTXSID00435717
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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