6-Bromo-N-methyl-N-phenyl-2H-1,3-benzodioxole-5-carboxamide
Basic information
- CAS
40141-79-5- Standard SMILES
CN(C(=O)c1cc2c(cc1Br)OCO2)c1ccccc1- InChIKey
OGUGYEXUYRBYSE-UHFFFAOYSA-N- Molecular formula
- C15H12BrNO3
- Average molar mass
- 334.16 g/mol
- Monoisotopic mass
- 333.00006
Names & identifiers
- Preferred name
- 6-Bromo-N-methyl-N-phenyl-2H-1,3-benzodioxole-5-carboxamide
- IUPAC
- 6-bromo-N-methyl-N-phenyl-1,3-benzodioxole-5-carboxamide
Names & synonyms
40141-79-5NSC270698DTXSID303134936-Bromo-N-methyl-N-phenyl-2H-1,3-benzodioxole-5-carboxamideNSC-270698
Database identifiers
- CAS
40141-79-5- PubChem CID
- 321174
- DTXSID
DTXSID30313493
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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