Name: Name:1-(1-phenylpropan-2-yl)-1H-pyrrole-2-carboxylic acid
Brand: Angene
SKU: AG01A4J3
Rating: 90 (10 reviews)

1-(1-phenylpropan-2-yl)-1H-pyrrole-2-carboxylic acid

CAS No.:

1432680-68-6

Catalog Number:

AG01A4J3

Molecular Formula:

C14H15NO2

Molecular Weight:

229.2744

Catalog Number:

AG01A4J3

Chemical Name:

1-(1-phenylpropan-2-yl)-1H-pyrrole-2-carboxylic acid

CAS Number:

1432680-68-6

Molecular Formula:

C14H15NO2

Molecular Weight:

229.2744

MDL Number:

MFCD17156190

IUPAC Name:

1-(1-phenylpropan-2-yl)pyrrole-2-carboxylic acid

InChI:

InChI=1S/C14H15NO2/c1-11(10-12-6-3-2-4-7-12)15-9-5-8-13(15)14(16)17/h2-9,11H,10H2,1H3,(H,16,17)

InChI Key:

KKMIUDPARJGYMX-UHFFFAOYSA-N

SMILES:

OC(=O)c1cccn1C(Cc1ccccc1)C

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.279g/mol

Monoisotopic Mass:

229.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8