Name: Name:2-chloro-5-(3-methylbutanamido)benzoic acid
Brand: Angene
SKU: AG01AKZ3
Rating: 90 (10 reviews)

2-chloro-5-(3-methylbutanamido)benzoic acid

CAS No.:

1030555-28-2

Catalog Number:

AG01AKZ3

Molecular Formula:

C12H14ClNO3

Molecular Weight:

255.6975

Catalog Number:

AG01AKZ3

Chemical Name:

2-chloro-5-(3-methylbutanamido)benzoic acid

CAS Number:

1030555-28-2

Molecular Formula:

C12H14ClNO3

Molecular Weight:

255.6975

MDL Number:

MFCD12651586

IUPAC Name:

2-chloro-5-(3-methylbutanoylamino)benzoic acid

InChI:

InChI=1S/C12H14ClNO3/c1-7(2)5-11(15)14-8-3-4-10(13)9(6-8)12(16)17/h3-4,6-7H,5H2,1-2H3,(H,14,15)(H,16,17)

InChI Key:

NBCLUGXQCNNVFC-UHFFFAOYSA-N

SMILES:

CC(CC(=O)Nc1ccc(c(c1)C(=O)O)Cl)C

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.066g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.698g/mol

Monoisotopic Mass:

255.066g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6