Name: Name:4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3-methylbenzoic acid
Brand: Angene
SKU: AG01AJ2D
Rating: 90 (10 reviews)

4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3-methylbenzoic acid

CAS No.:

864296-62-8

Catalog Number:

AG01AJ2D

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

Catalog Number:

AG01AJ2D

Chemical Name:

4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3-methylbenzoic acid

CAS Number:

864296-62-8

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

MDL Number:

MFCD09812843

IUPAC Name:

4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3-methylbenzoic acid

InChI:

InChI=1S/C11H13NO4S/c1-8-7-9(11(13)14)3-4-10(8)12-5-2-6-17(12,15)16/h3-4,7H,2,5-6H2,1H3,(H,13,14)

InChI Key:

DWQKZCIMVWJIBS-UHFFFAOYSA-N

SMILES:

Cc1cc(ccc1N1CCCS1(=O)=O)C(=O)O

Complexity:

400

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.288g/mol

Monoisotopic Mass:

255.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1