Name: Name:1-(2,6-difluorophenyl)-5-oxopyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG01A4C9
Rating: 90 (10 reviews)

1-(2,6-difluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS No.:

934189-18-1

Catalog Number:

AG01A4C9

Molecular Formula:

C11H9F2NO3

Molecular Weight:

241.1909

Catalog Number:

AG01A4C9

Chemical Name:

1-(2,6-difluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS Number:

934189-18-1

Molecular Formula:

C11H9F2NO3

Molecular Weight:

241.1909

MDL Number:

MFCD10692043

IUPAC Name:

1-(2,6-difluorophenyl)-5-oxopyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C11H9F2NO3/c12-7-2-1-3-8(13)10(7)14-5-6(11(16)17)4-9(14)15/h1-3,6H,4-5H2,(H,16,17)

InChI Key:

KOQJSUJYOHBXCB-UHFFFAOYSA-N

SMILES:

OC(=O)C1CN(C(=O)C1)c1c(F)cccc1F

Complexity:

327

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.055g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.194g/mol

Monoisotopic Mass:

241.055g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7