Name: Name:5-bromo-2-methylbenzo[b]thiophene-1,1-dioxide
Brand: Angene
SKU: AG01DZY8
Rating: 90 (10 reviews)

5-bromo-2-methylbenzo[b]thiophene-1,1-dioxide

CAS No.:

63166-90-5

Catalog Number:

AG01DZY8

Molecular Formula:

C9H7BrO2S

Molecular Weight:

259.1197

Catalog Number:

AG01DZY8

Chemical Name:

5-bromo-2-methylbenzo[b]thiophene-1,1-dioxide

CAS Number:

63166-90-5

Molecular Formula:

C9H7BrO2S

Molecular Weight:

259.1197

MDL Number:

MFCD27926664

IUPAC Name:

5-bromo-2-methyl-1-benzothiophene 1,1-dioxide

InChI:

InChI=1S/C9H7BrO2S/c1-6-4-7-5-8(10)2-3-9(7)13(6,11)12/h2-5H,1H3

InChI Key:

BOTHUOPKKBBNRR-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)C=C(S2(=O)=O)C

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.935g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.117g/mol

Monoisotopic Mass:

257.935g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4