AG000OSQ

1258298-01-9 | Benzoic acid, 2,6-dichloro-4-iodo-

AG000OSQ

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CAS Number	1258298-01-9
Catalog Number	AG000OSQ(AGN-PC-093FH9)
Chemical Name	Benzoic acid, 2,6-dichloro-4-iodo-
IUPAC Name	2,6-dichloro-4-iodobenzoic acid
InChI	InChI=1S/C7H3Cl2IO2/c8-4-1-3(10)2-5(9)6(4)7(11)12/h1-2H,(H,11,12)
InChI Key	XXOKETZHRNJXMT-UHFFFAOYSA-N
MDL Number	MFCD22690836
Molecular Formula	C7H3Cl2IO2
Molecular Weight	316.9080
SMILES	O=C(O)C1=C(Cl)C=C(I)C=C1Cl
Synonyms	2,6-dichloro-4-iodobenzoic acid, 1258298-01-9, Benzoic acid, 2,6-dichloro-4-iodo-, AK161218, SCHEMBL793000, AMBZ0051, XXOKETZHRNJXMT-UHFFFAOYSA-N, 2,6-dichloro-4-iodo-benzoic acid, Benzoicacid,2,6-dichloro-4-iodo-, KS-000000ZL, 3258AD, MFCD22690836, ZINC95698518, AKOS024464644, AM84943, DS-7260, FCH2309464, OR302489, AJ-133538, AX8294178, 4CH-022766, FT-0697493, ST24038823, C7H3Cl2IO2, 2,6-Dichloro-4-iodobenzoic acid, 95% - 1G 1g,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	315.855g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	316.903g/mol
Monoisotopic Mass	315.855g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

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