Basic information
- CAS
67648-30-0- Standard SMILES
CCCCOC(=O)Nc1cc(Cl)ccc1C- InChIKey
RMKHMFXHMIXHQX-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO2
- Average molar mass
- 241.71 g/mol
- Monoisotopic mass
- 241.0869564
Names & identifiers
- Preferred name
- Butyl (5-chloro-2-methylphenyl)carbamate
- IUPAC
- butyl N-(5-chloro-2-methylphenyl)carbamate
Names & synonyms
butyl (5-chloro-2-methylphenyl)carbamate67648-30-0NSC28545butyl N-(5-chloro-2-methylphenyl)carbamateMLS000534121CHEMBL1559549DTXSID90987013HMS2286L24NSC-28545AKOS002266434SMR000141558ST50190117
Show more names
butoxy-N-(5-chloro-2-methylphenyl)carboxamideAB00115563-01Butyl hydrogen (5-chloro-2-methylphenyl)carbonimidate
Database identifiers
- CAS
67648-30-0- PubChem CID
- 231815
- DTXSID
DTXSID90987013- ChEMBL
CHEMBL1559549
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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