Basic information
- CAS
4560-89-8- Standard SMILES
CNC(=O)Oc1cc(C)ccc1Cl- InChIKey
SYQANWGBKWPXCT-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO2
- Average molar mass
- 199.63 g/mol
- Monoisotopic mass
- 199.0400063
Names & identifiers
- Preferred name
- Phenol, 2-chloro-5-methyl-, methylcarbamate
- IUPAC
- (2-chloro-5-methylphenyl) N-methylcarbamate
Names & synonyms
Phenol, 2-chloro-5-methyl-, methylcarbamate4560-89-8DTXSID401965722-Chloro-5-methylphenyl methylcarbamate
Database identifiers
- CAS
4560-89-8- PubChem CID
- 6452033
- DTXSID
DTXSID40196572
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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