Name: Name:1-(4-Fluorobenzoyl)-4-hydroxy-2-pyrrolidinecarboxylic acid
Brand: Angene
SKU: AG00D87E
Rating: 90 (10 reviews)

1-(4-Fluorobenzoyl)-4-hydroxy-2-pyrrolidinecarboxylic acid

CAS No.:

497163-88-9

Catalog Number:

AG00D87E

Molecular Formula:

C12H12FNO4

Molecular Weight:

253.2264

Catalog Number:

AG00D87E

Chemical Name:

1-(4-Fluorobenzoyl)-4-hydroxy-2-pyrrolidinecarboxylic acid

CAS Number:

497163-88-9

Molecular Formula:

C12H12FNO4

Molecular Weight:

253.2264

MDL Number:

MFCD00202775

IUPAC Name:

1-(4-fluorobenzoyl)-4-hydroxypyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C12H12FNO4/c13-8-3-1-7(2-4-8)11(16)14-6-9(15)5-10(14)12(17)18/h1-4,9-10,15H,5-6H2,(H,17,18)

InChI Key:

ZQKMWRGUSKTUKM-UHFFFAOYSA-N

SMILES:

OC1CN(C(C1)C(=O)O)C(=O)c1ccc(cc1)F

Complexity:

341

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.229g/mol

Monoisotopic Mass:

253.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6