Name: Name:1,3,3-trimethyl-2,2-dioxo-1,3-dihydro-2lambda6,1-benzothiazole-5-carboxylic acid
Brand: Angene
SKU: AG01BV1V
Rating: 90 (10 reviews)

1,3,3-trimethyl-2,2-dioxo-1,3-dihydro-2lambda6,1-benzothiazole-5-carboxylic acid

CAS No.:

2044796-43-0

Catalog Number:

AG01BV1V

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

Catalog Number:

AG01BV1V

Chemical Name:

1,3,3-trimethyl-2,2-dioxo-1,3-dihydro-2lambda6,1-benzothiazole-5-carboxylic acid

CAS Number:

2044796-43-0

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

MDL Number:

MFCD30476222

IUPAC Name:

1,3,3-trimethyl-2,2-dioxo-2,1-benzothiazole-5-carboxylic acid

InChI:

InChI=1S/C11H13NO4S/c1-11(2)8-6-7(10(13)14)4-5-9(8)12(3)17(11,15)16/h4-6H,1-3H3,(H,13,14)

InChI Key:

LWEUAEQGIMFHMI-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)C(C)(C)S(=O)(=O)N2C

Complexity:

437

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:

0.8