Name: Name:3-Bromo-4-fluoro-5-(chlorosulfonyl)benzoic acid
Brand: Angene
SKU: AG01EY06
Rating: 90 (10 reviews)

3-Bromo-4-fluoro-5-(chlorosulfonyl)benzoic acid

CAS No.:

869529-35-1

Catalog Number:

AG01EY06

Molecular Formula:

C7H3BrClFO4S

Molecular Weight:

317.5167

Catalog Number:

AG01EY06

Chemical Name:

3-Bromo-4-fluoro-5-(chlorosulfonyl)benzoic acid

CAS Number:

869529-35-1

Molecular Formula:

C7H3BrClFO4S

Molecular Weight:

317.5167

MDL Number:

MFCD16817594

IUPAC Name:

3-bromo-5-chlorosulfonyl-4-fluorobenzoic acid

InChI:

InChI=1S/C7H3BrClFO4S/c8-4-1-3(7(11)12)2-5(6(4)10)15(9,13)14/h1-2H,(H,11,12)

InChI Key:

POHGXELFKXTYQB-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(Br)c(c(c1)S(=O)(=O)Cl)F

Complexity:

355

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

315.861g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

317.509g/mol

Monoisotopic Mass:

315.861g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3