Name: Name:3-bromo-5-(chlorosulfonyl)-2,6-dimethylbenzoic acid
Brand: Angene
SKU: AG01ALYO
Rating: 90 (10 reviews)

3-bromo-5-(chlorosulfonyl)-2,6-dimethylbenzoic acid

CAS No.:

1909325-10-5

Catalog Number:

AG01ALYO

Molecular Formula:

C9H8BrClO4S

Molecular Weight:

327.5794

Catalog Number:

AG01ALYO

Chemical Name:

3-bromo-5-(chlorosulfonyl)-2,6-dimethylbenzoic acid

CAS Number:

1909325-10-5

Molecular Formula:

C9H8BrClO4S

Molecular Weight:

327.5794

MDL Number:

MFCD29054834

IUPAC Name:

3-bromo-5-chlorosulfonyl-2,6-dimethylbenzoic acid

InChI:

InChI=1S/C9H8BrClO4S/c1-4-6(10)3-7(16(11,14)15)5(2)8(4)9(12)13/h3H,1-2H3,(H,12,13)

InChI Key:

PGLYPUURWDPSRP-UHFFFAOYSA-N

SMILES:

OC(=O)c1c(C)c(Br)cc(c1C)S(=O)(=O)Cl

Complexity:

378

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

325.902g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.573g/mol

Monoisotopic Mass:

325.902g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9