Basic information
- CAS
58708-50-2- Standard SMILES
Cc1cc(Br)cc(C(N)=O)c1OCC1CO1- InChIKey
TWXDZXRKESXXCF-UHFFFAOYSA-N- Molecular formula
- C11H12BrNO3
- Average molar mass
- 286.12 g/mol
- Monoisotopic mass
- 285.00006
Names & identifiers
- Preferred name
- 5-Bromo-3-methyl-2-(2-oxiranylmethoxy)benzamide
- IUPAC
- 5-bromo-3-methyl-2-(oxiran-2-ylmethoxy)benzamide
Names & synonyms
58708-50-2RefChem:10727235-Bromo-3-methyl-2-(2-oxiranylmethoxy)benzamide5-Bromo-3-methyl-2-(oxiranylmethoxy)benzamideBRN 1379604BENZAMIDE, 5-BROMO-3-METHYL-2-(OXIRANYLMETHOXY)-5-17-03-00039 (Beilstein Handbook Reference)DTXSID009742325-Bromo-3-methyl-2-[(oxiran-2-yl)methoxy]benzene-1-carboximidic acid
Database identifiers
- CAS
58708-50-2- PubChem CID
- 42818
- DTXSID
DTXSID00974232
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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