Name: Name:1-(5-chloro-2-methoxybenzoyl)pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01EKIR
Rating: 90 (10 reviews)

1-(5-chloro-2-methoxybenzoyl)pyrrolidine-2-carboxylic acid

CAS No.:

1101860-80-3

Catalog Number:

AG01EKIR

Molecular Formula:

C13H14ClNO4

Molecular Weight:

283.7076

Catalog Number:

AG01EKIR

Chemical Name:

1-(5-chloro-2-methoxybenzoyl)pyrrolidine-2-carboxylic acid

CAS Number:

1101860-80-3

Molecular Formula:

C13H14ClNO4

Molecular Weight:

283.7076

MDL Number:

MFCD09812458

IUPAC Name:

1-(5-chloro-2-methoxybenzoyl)pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C13H14ClNO4/c1-19-11-5-4-8(14)7-9(11)12(16)15-6-2-3-10(15)13(17)18/h4-5,7,10H,2-3,6H2,1H3,(H,17,18)

InChI Key:

IIQLZUFRZAJAHH-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1C(=O)N1CCCC1C(=O)O)Cl

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.708g/mol

Monoisotopic Mass:

283.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1