2-Bromophenyl methylcarbamate
Basic information
- CAS
13538-27-7- Standard SMILES
CNC(=O)Oc1ccccc1Br- InChIKey
HHMDSPJREHDNKG-UHFFFAOYSA-N- Molecular formula
- C8H8BrNO2
- Average molar mass
- 230.06 g/mol
- Monoisotopic mass
- 228.97384
Names & identifiers
- Preferred name
- 2-Bromophenyl methylcarbamate
- IUPAC
- (2-bromophenyl) N-methylcarbamate
Names & synonyms
2-bromophenyl methylcarbamate13538-27-7DTXSID70284779RefChem:257695DTXCID40235930NSC38960NSC-38960
Database identifiers
- CAS
13538-27-7- PubChem CID
- 236441
- DTXSID
DTXSID70284779- Nikkaji
- J1.579.681B
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Experimental & physicochemical properties
LogP1.77
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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