Name: Name:1-[2-(difluoromethoxy)benzoyl]pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01EKIF
Rating: 90 (10 reviews)

1-[2-(difluoromethoxy)benzoyl]pyrrolidine-2-carboxylic acid

CAS No.:

1101842-37-8

Catalog Number:

AG01EKIF

Molecular Formula:

C13H13F2NO4

Molecular Weight:

285.2434

Catalog Number:

AG01EKIF

Chemical Name:

1-[2-(difluoromethoxy)benzoyl]pyrrolidine-2-carboxylic acid

CAS Number:

1101842-37-8

Molecular Formula:

C13H13F2NO4

Molecular Weight:

285.2434

MDL Number:

MFCD02339988

IUPAC Name:

1-[2-(difluoromethoxy)benzoyl]pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C13H13F2NO4/c14-13(15)20-10-6-2-1-4-8(10)11(17)16-7-3-5-9(16)12(18)19/h1-2,4,6,9,13H,3,5,7H2,(H,18,19)

InChI Key:

QTAYEQHTTYYOEZ-UHFFFAOYSA-N

SMILES:

FC(Oc1ccccc1C(=O)N1CCCC1C(=O)O)F

Complexity:

377

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

285.081g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.247g/mol

Monoisotopic Mass:

285.081g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4