AG00IIT4

951884-96-1 | 3-Bromo-2,4-dichlorobenzoic acid

AG00IIT4

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CAS Number	951884-96-1
Catalog Number	AG00IIT4(AGN-PC-0570E5)
Chemical Name	3-Bromo-2,4-dichlorobenzoic acid
IUPAC Name	3-bromo-2,4-dichlorobenzoic acid
InChI	InChI=1S/C7H3BrCl2O2/c8-5-4(9)2-1-3(6(5)10)7(11)12/h1-2H,(H,11,12)
InChI Key	OCILIDFQDDWNEN-UHFFFAOYSA-N
MDL Number	MFCD09800918
Molecular Formula	C7H3BrCl2O2
Molecular Weight	269.9075
SMILES	OC(=O)C1=CC=C(Cl)C(Br)=C1Cl
Synonyms	3-Bromo-2,4-dichlorobenzoic acid, 951884-96-1, ACMC-209rx1, CTK5H7506, DTXSID00650069, ZX-AT000858, ANW-40451, MFCD09800918, ZINC15021437, AKOS015833884, FCH1393464, OR11909, RTR-029728, AJ-66993, AS-33311, AX8250281, TR-029728, V9566, B-4559, I01-10839, C7H3BrCl2O2, 3-Bromo-2,4-dichlorobenzoicacid,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.869g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	269.903g/mol
Monoisotopic Mass	267.869g/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

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