AG00FH0B

702640-51-5 | 3-Bromo-6-chloro-2-fluorobenzoic acid

AG00FH0B

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CAS Number	702640-51-5
Catalog Number	AG00FH0B(AGN-PC-0WD06W)
Chemical Name	3-Bromo-6-chloro-2-fluorobenzoic acid
IUPAC Name	3-bromo-6-chloro-2-fluorobenzoic acid
InChI	InChI=1S/C7H3BrClFO2/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2H,(H,11,12)
InChI Key	RMFKXLDHDDWWGR-UHFFFAOYSA-N
MDL Number	MFCD11110256
Molecular Formula	C7H3BrClFO2
Molecular Weight	253.4529
SMILES	c1(ccc(c(c1F)C(=O)O)Cl)Br
Synonyms	3-Bromo-6-chloro-2-fluorobenzoic acid, 702640-51-5, 2-chloro-5-bromo-6-fluorobenzoic acid, SCHEMBL3822577, RMFKXLDHDDWWGR-UHFFFAOYSA-N, MFCD11110256, ZINC75914857, AKOS022181427, FCH1402652, AS-19884, PC500462, AJ-122100, ST24041942, Z0794, Q-8863, AS-813/43501811, C7H3BrClFO2, 3-BROMO-6-CHLORO-2-FLUOROBENZOICACID,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.899g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	253.451g/mol
Monoisotopic Mass	251.899g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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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