Name: Name:Benzoic acid, 3-(chlorosulfonyl)-4-methoxy-, methyl ester
Brand: Angene
SKU: AG002FTY
Rating: 90 (10 reviews)

Benzoic acid, 3-(chlorosulfonyl)-4-methoxy-, methyl ester

CAS No.:

192323-12-9

Catalog Number:

AG002FTY

Molecular Formula:

C9H9ClO5S

Molecular Weight:

264.6828

Catalog Number:

AG002FTY

Chemical Name:

Benzoic acid, 3-(chlorosulfonyl)-4-methoxy-, methyl ester

CAS Number:

192323-12-9

Molecular Formula:

C9H9ClO5S

Molecular Weight:

264.6828

MDL Number:

MFCD03407355

IUPAC Name:

methyl 3-chlorosulfonyl-4-methoxybenzoate

InChI:

InChI=1S/C9H9ClO5S/c1-14-7-4-3-6(9(11)15-2)5-8(7)16(10,12)13/h3-5H,1-2H3

InChI Key:

FKAIQWMEWVOGDP-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc(c(c1)S(=O)(=O)Cl)OC

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.986g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.676g/mol

Monoisotopic Mass:

263.986g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8