Name: Name:4-(2,5-dihydro-1H-pyrrol-1-yl)benzoic acid
Brand: Angene
SKU: AG01AJL4
Rating: 90 (10 reviews)

4-(2,5-dihydro-1H-pyrrol-1-yl)benzoic acid

CAS No.:

1334011-98-1

Catalog Number:

AG01AJL4

Molecular Formula:

C11H11NO2

Molecular Weight:

189.2105

Catalog Number:

AG01AJL4

Chemical Name:

4-(2,5-dihydro-1H-pyrrol-1-yl)benzoic acid

CAS Number:

1334011-98-1

Molecular Formula:

C11H11NO2

Molecular Weight:

189.2105

MDL Number:

MFCD19686275

IUPAC Name:

4-(2,5-dihydropyrrol-1-yl)benzoic acid

InChI:

InChI=1S/C11H11NO2/c13-11(14)9-3-5-10(6-4-9)12-7-1-2-8-12/h1-6H,7-8H2,(H,13,14)

InChI Key:

CIPIDQRZVASIGN-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)N1CC=CC1

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.214g/mol

Monoisotopic Mass:

189.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8