Name: Name:5,6-dimethoxy-2,3-dihydro-1,2-benzothiazole-1,1,3-trione
Brand: Angene
SKU: AG01A96W
Rating: 90 (10 reviews)

5,6-dimethoxy-2,3-dihydro-1,2-benzothiazole-1,1,3-trione

CAS No.:

60987-22-6

Catalog Number:

AG01A96W

Molecular Formula:

C9H9NO5S

Molecular Weight:

243.2365

Catalog Number:

AG01A96W

Chemical Name:

5,6-dimethoxy-2,3-dihydro-1,2-benzothiazole-1,1,3-trione

CAS Number:

60987-22-6

Molecular Formula:

C9H9NO5S

Molecular Weight:

243.2365

MDL Number:

MFCD16547663

IUPAC Name:

5,6-dimethoxy-1,1-dioxo-1,2-benzothiazol-3-one

InChI:

InChI=1S/C9H9NO5S/c1-14-6-3-5-8(4-7(6)15-2)16(12,13)10-9(5)11/h3-4H,1-2H3,(H,10,11)

InChI Key:

SUIQIOALWGAJCD-UHFFFAOYSA-N

SMILES:

COc1cc2c(cc1OC)C(=O)NS2(=O)=O

Complexity:

387

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.233g/mol

Monoisotopic Mass:

243.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9