Name: Name:2H-Pyrrole-2-carboxylic acid, 3,4-dihydro-5-phenyl-, methyl ester
Brand: Angene
SKU: AG007RL7
Rating: 90 (10 reviews)

2H-Pyrrole-2-carboxylic acid, 3,4-dihydro-5-phenyl-, methyl ester

CAS No.:

111836-35-2

Catalog Number:

AG007RL7

Molecular Formula:

C12H13NO2

Molecular Weight:

203.2371

Catalog Number:

AG007RL7

Chemical Name:

2H-Pyrrole-2-carboxylic acid, 3,4-dihydro-5-phenyl-, methyl ester

CAS Number:

111836-35-2

Molecular Formula:

C12H13NO2

Molecular Weight:

203.2371

MDL Number:

MFCD02941564

IUPAC Name:

methyl 5-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylate

InChI:

InChI=1S/C12H13NO2/c1-15-12(14)11-8-7-10(13-11)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3

InChI Key:

NAXNNWHGOJPWKA-UHFFFAOYSA-N

SMILES:

COC(=O)C1CCC(=N1)c1ccccc1

Complexity:

267

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

203.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

203.241g/mol

Monoisotopic Mass:

203.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8