Name: Name:4-(3,4-dimethylbenzenesulfonamido)butanoic acid
Brand: Angene
SKU: AG019JZG
Rating: 90 (10 reviews)

4-(3,4-dimethylbenzenesulfonamido)butanoic acid

CAS No.:

857041-67-9

Catalog Number:

AG019JZG

Molecular Formula:

C12H17NO4S

Molecular Weight:

271.3327

Catalog Number:

AG019JZG

Chemical Name:

4-(3,4-dimethylbenzenesulfonamido)butanoic acid

CAS Number:

857041-67-9

Molecular Formula:

C12H17NO4S

Molecular Weight:

271.3327

MDL Number:

MFCD06655151

IUPAC Name:

4-[(3,4-dimethylphenyl)sulfonylamino]butanoic acid

InChI:

InChI=1S/C12H17NO4S/c1-9-5-6-11(8-10(9)2)18(16,17)13-7-3-4-12(14)15/h5-6,8,13H,3-4,7H2,1-2H3,(H,14,15)

InChI Key:

GOFYWSSBNXVGIW-UHFFFAOYSA-N

SMILES:

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

Complexity:

374

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.088g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.331g/mol

Monoisotopic Mass:

271.088g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5