Name: Name:2-(3,4-dimethylbenzenesulfonamido)propanoic acid
Brand: Angene
SKU: AG019JIH
Rating: 90 (10 reviews)

2-(3,4-dimethylbenzenesulfonamido)propanoic acid

CAS No.:

1009782-12-0

Catalog Number:

AG019JIH

Molecular Formula:

C11H15NO4S

Molecular Weight:

257.3061

Catalog Number:

AG019JIH

Chemical Name:

2-(3,4-dimethylbenzenesulfonamido)propanoic acid

CAS Number:

1009782-12-0

Molecular Formula:

C11H15NO4S

Molecular Weight:

257.3061

MDL Number:

MFCD05148220

IUPAC Name:

2-[(3,4-dimethylphenyl)sulfonylamino]propanoic acid

InChI:

InChI=1S/C11H15NO4S/c1-7-4-5-10(6-8(7)2)17(15,16)12-9(3)11(13)14/h4-6,9,12H,1-3H3,(H,13,14)

InChI Key:

WXVOUJHWGQVTLJ-UHFFFAOYSA-N

SMILES:

OC(=O)C(NS(=O)(=O)c1ccc(c(c1)C)C)C

Complexity:

373

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.072g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.304g/mol

Monoisotopic Mass:

257.072g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6