Basic information
- CAS
87623-14-1- Standard SMILES
CCOC(=O)Nc1ccc(C2OCCS2)cc1- InChIKey
HIOPJDRYJSGLRB-UHFFFAOYSA-N- Molecular formula
- C12H15NO3S
- Average molar mass
- 253.32 g/mol
- Monoisotopic mass
- 253.07726451
Names & identifiers
- Preferred name
- ethyl N-[4-(1,3-oxathiolan-2-yl)phenyl]carbamate
- IUPAC
- ethyl N-[4-(1,3-oxathiolan-2-yl)phenyl]carbamate
Names & synonyms
ethyl N-[4-(1,3-oxathiolan-2-yl)phenyl]carbamate87623-14-1NSC377841Ethyl [4-(1,3-oxathiolan-2-yl)phenyl]carbamateDTXSID10321571NSC-377841
Database identifiers
- CAS
87623-14-1- PubChem CID
- 342190
- DTXSID
DTXSID10321571
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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