Basic information
- Standard SMILES
COC(=O)c1cc(Br)c(Br)n1C- InChIKey
UTOZAUBXQWRZIF-UHFFFAOYSA-N- Molecular formula
- C7H7Br2NO2
- Average molar mass
- 296.94 g/mol
Names & identifiers
- Preferred name
- Methyl 4,5-Dibromo-1-Methylpyrrole-2-Carboxylate
- IUPAC
- methyl 4,5-dibromo-1-methylpyrrole-2-carboxylate
Names & synonyms
methyl 4,5-dibromo-1-methylpyrrole-2-carboxylateRefChem:157538Methyl-45-dibromocarboxylate methyl esterMethyl-45-dibromocarboxylic acid methyl esterMethyl 4,5-dibromo-1-methylpyrrole-2-carboxylic acidMethyl 4,5-dibromo-1-methyl-1H-pyrrole-2-carboxylic acid1198-71-6MFCD25956429methyl 4,5-dibromo-1-methyl-1H-pyrrole-2-carboxylate1H-Pyrrole-2-carboxylic acid, 4,5-dibromo-1-methyl-, methyl esterMethyl 45-Dibromo-1-methylpyrrole-2-carboxylateNSC622156
Show more names
Methyl4,5-Dibromo-1-methylpyrrole-2-carboxylateCHEMBL598919SCHEMBL1518390UTOZAUBXQWRZIF-UHFFFAOYSA-NAC2432AKOS027256710NSC-622156SB62495
Database identifiers
- PubChem CID
- 360185
- ChEMBL
CHEMBL598919
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Related reactions
6 records
Compound notes
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