AG002UZ2

2786-00-7 | Benzoic acid, 5-iodo-2-methoxy-

AG002UZ2

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CAS Number	2786-00-7
Catalog Number	AG002UZ2(AGN-PC-0L531C)
Chemical Name	Benzoic acid, 5-iodo-2-methoxy-
IUPAC Name	5-iodo-2-methoxybenzoic acid
InChI	InChI=1S/C8H7IO3/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key	FVEBPHMWZVPXQS-UHFFFAOYSA-N
MDL Number	MFCD02683859
Molecular Formula	C8H7IO3
Molecular Weight	278.0439
SMILES	IC=1C=CC(=C(C(=O)O)C1)OC
Synonyms	5-iodo-2-methoxybenzoic acid, 2786-00-7, 2-Methoxy-5-iodobenzoic acid, Benzoic acid, 5-iodo-2-methoxy-, 5-Jod-methoxybenzoesaure, AC1N3EI6, SCHEMBL233846, Benzoic acid,5-iodo-2-methoxy-, CTK4G0360, DTXSID70399155, FVEBPHMWZVPXQS-UHFFFAOYSA-N, ZINC2583732, MFCD02683859, 5-Iodo-2-methoxybenzoic acid, 97%, AKOS005201281, AS02243, MCULE-7864465132, AJ-43271, AK-93292, AS-49549, AB0000693, ST2401916, 4CH-019454, W-3878, 5-Iodo-2-methoxybenzoicacid, 5-iodo-2-methoxy-benzoic Acid, CID4086166,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	277.944g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	278.045g/mol
Monoisotopic Mass	277.944g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number