1H-Pyrrole-2-carboxylic acid, 4-methyl-3-phenyl-, ethyl ester

HCID 10704591

Basic information

CAS
124901-12-8
Standard SMILES
CCOC(=O)c1[nH]cc(C)c1-c1ccccc1
InChIKey
ZXBOCLDHYGJYDU-UHFFFAOYSA-N
Molecular formula
C14H15NO2
Average molar mass
229.27 g/mol
Monoisotopic mass
229.11027872

Names & identifiers

Preferred name
1H-Pyrrole-2-carboxylic acid, 4-methyl-3-phenyl-, ethyl ester
IUPAC
ethyl 4-methyl-3-phenyl-1H-pyrrole-2-carboxylate

Names & synonyms

124901-12-81H-Pyrrole-2-carboxylic acid, 4-methyl-3-phenyl-, ethyl esterDTXSID60443772RefChem:240517DTXCID60394593Ethyl 4-methyl-3-phenyl-1H-pyrrole-2-carboxylateSCHEMBL1126789ZXBOCLDHYGJYDU-UHFFFAOYSA-NDB-360503ethyl 4-methyl-3-phenyl-1h-pyrrole-2-carboxy-late4-methyl-3-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester

Database identifiers

CAS
124901-12-8
PubChem CID
10704591
DTXSID
DTXSID60443772
Nikkaji
J3.196.010J

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
42.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17

Related reactions

4 records

Compound notes

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