AG0079VD

35674-28-3 | 5-Iodo-2-nitrobenzoic acid

AG0079VD

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CAS Number	35674-28-3
Catalog Number	AG0079VD(AGN-PC-00NV36)
Chemical Name	5-Iodo-2-nitrobenzoic acid
IUPAC Name	5-iodo-2-nitrobenzoic acid
InChI	InChI=1S/C7H4INO4/c8-4-1-2-6(9(12)13)5(3-4)7(10)11/h1-3H,(H,10,11)
InChI Key	RYOSQAPCAPOLCV-UHFFFAOYSA-N
MDL Number	MFCD07783659
Molecular Formula	C7H4INO4
Molecular Weight	293.0154
SMILES	OC(=O)C1=C(C=CC(I)=C1)[N+]([O-])=O
Synonyms	5-iodo-2-nitrobenzoic acid, 35674-28-3, 5-iodo-2-nitro-benzoic acid, SCHEMBL275456, Benzoic acid, 5-iodo-2-nitro-, CTK8C4169, DTXSID60548519, RYOSQAPCAPOLCV-UHFFFAOYSA-N, ANW-71171, MFCD07783659, TD1239, ZINC34143793, AKOS016008137, AC-28701, AJ-87154, AS-54704, SC-36174, AB0088388, DB-069247, TC-159916, 4CH-000819, FT-0733062, ST24044802, TL80090342, F1967-1685, 5-Iodo-2-nitrobenzoicacid,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	292.919g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	293.016g/mol
Monoisotopic Mass	292.919g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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

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