3-Sulphophthalic acid

Catalog Number	ACM67892437-2
CAS	67892-43-7
Structure
Synonyms	3-Sulfo-1,2-benzenedicarboxylic acid
IUPAC Name	3-sulfophthalic acid
Molecular Weight	246.19
Molecular Formula	C8H6O7S
InChI	InChI=1S/C8H6O7S/c9-7(10)4-2-1-3-5(16(13,14)15)6(4)8(11)12/h1-3H,(H,9,10)(H,11,12)(H,13,14,15)
InChI Key	SDGNNLQZAPXALR-UHFFFAOYSA-N
Purity	97%
Complexity	393
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
EC Number	267-576-5;247-885-1
Exact Mass	245.98342370g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Monoisotopic Mass	245.98342370g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	137Ų