2-Iodoterephthalic acid

Catalog Number	ACM1829227-1
CAS	1829-22-7
Structure
Synonyms	BDC-I
IUPAC Name	2-iodoterephthalic acid
Molecular Weight	292.03
Molecular Formula	C8H5O4I
InChI	InChI=1S/C8H5IO4/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI Key	LUZKKRPROWYBLR-UHFFFAOYSA-N
Purity	98%
Appearance	Off-white solid
Complexity	228
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	291.92326g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Monoisotopic Mass	291.92326g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	74.6Ų