Methyl 4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
Basic information
- CAS
103999-52-6- Standard SMILES
COC(=O)c1c[nH]cc1-c1ccc(Cl)c(Cl)c1- InChIKey
WRGWTNAGWNCVTF-UHFFFAOYSA-N- Molecular formula
- C12H9Cl2NO2
- Average molar mass
- 270.11 g/mol
- Monoisotopic mass
- 269.0010339
Names & identifiers
- Preferred name
- Methyl 4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
- IUPAC
- methyl 4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
- English name
- 4-(3,4-Dichlorophenyl)-1H-pyrrole-3-carboxylicacidmethylester
- Molecular formula
- C12H9Cl2NO2
- Molecular weight
- 270.11
Names & synonyms
103999-52-6Methyl 4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate4-(3,4-DICHLOROPHENYL)-1H-PYRROLE-3-CARBOXYLIC ACID METHYL ESTERDTXSID506953294-(3,4-DICHLOROPHENYL)-1H-PYRROLE-3-CARBOXYLICACIDMETHYLESTER1H-Pyrrole-3-carboxylic acid, 4-(3,4-dichlorophenyl)-, methyl ester
Database identifiers
- CAS
103999-52-6- PubChem CID
- 53404135
- DTXSID
DTXSID50695329
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 42.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 288
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…