Name: Name:2,1-Benzisothiazole, 5-bromo-1,3-dihydro-, 2,2-dioxide
Brand: Angene
SKU: AG0096DC
Rating: 90 (10 reviews)

2,1-Benzisothiazole, 5-bromo-1,3-dihydro-, 2,2-dioxide

CAS No.:

111248-92-1

Catalog Number:

AG0096DC

Molecular Formula:

C7H6BrNO2S

Molecular Weight:

248.0970

Catalog Number:

AG0096DC

Chemical Name:

2,1-Benzisothiazole, 5-bromo-1,3-dihydro-, 2,2-dioxide

CAS Number:

111248-92-1

Molecular Formula:

C7H6BrNO2S

Molecular Weight:

248.0970

MDL Number:

MFCD20231137

IUPAC Name:

5-bromo-1,3-dihydro-2,1-benzothiazole 2,2-dioxide

InChI:

InChI=1S/C7H6BrNO2S/c8-6-1-2-7-5(3-6)4-12(10,11)9-7/h1-3,9H,4H2

InChI Key:

LYURFBYYEXMNJD-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)CS(=O)(=O)N2

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

246.93g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.094g/mol

Monoisotopic Mass:

246.93g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2