Name: Name:1-(4-chloro-3-fluorophenyl)-5-oxopyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG01A3P0
Rating: 90 (10 reviews)

1-(4-chloro-3-fluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS No.:

1270831-90-7

Catalog Number:

AG01A3P0

Molecular Formula:

C11H9ClFNO3

Molecular Weight:

257.6455

Catalog Number:

AG01A3P0

Chemical Name:

1-(4-chloro-3-fluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS Number:

1270831-90-7

Molecular Formula:

C11H9ClFNO3

Molecular Weight:

257.6455

MDL Number:

MFCD16179097

IUPAC Name:

1-(4-chloro-3-fluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C11H9ClFNO3/c12-8-2-1-7(4-9(8)13)14-5-6(11(16)17)3-10(14)15/h1-2,4,6H,3,5H2,(H,16,17)

InChI Key:

YXJIDESZQKFMAO-UHFFFAOYSA-N

SMILES:

OC(=O)C1CC(=O)N(C1)c1ccc(c(c1)F)Cl

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.025g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.645g/mol

Monoisotopic Mass:

257.025g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2