Basic information
- CAS
2313-93-1- Standard SMILES
CC(=O)CNC(=O)Oc1cc(C)c(C)cc1Cl- InChIKey
MJCKKOWJBTWJKL-UHFFFAOYSA-N- Molecular formula
- C12H14ClNO3
- Average molar mass
- 255.7 g/mol
- Monoisotopic mass
- 255.066221
Names & identifiers
- Preferred name
- AI 3-27262
- IUPAC
- (2-chloro-4,5-dimethylphenyl) N-(2-oxopropyl)carbamate
- English name
- N-Acetyl-N-methylcarbamic acid 2-chloro-4,5-dimethylphenyl ester
- Molecular weight
- 0
Names & synonyms
2313-93-1AI 3-27262RefChem:1076242Upjohn U-12379ENT 27,262BRN 2055523Carbamic acid, acetylmethyl-, 2-chloro-4,5-dimethylphenyl esterAI3-272622-Chloro-4,5-dimethylphenyl acetylmethylcarbamateU-12379Carbamic acid, acetylmethyl-, 6-chloro-3,4-xylyl esterDTXSID80945809
Show more names
2-Chloro-4,5-dimethylphenyl hydrogen (2-oxopropyl)carbonimidateN-Acetyl-N-methylcarbamic acid 2-chloro-4,5-dimethylphenyl ester
Database identifiers
- CAS
2313-93-1- PubChem CID
- 75334
- DTXSID
DTXSID80945809
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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