AG01FPL3

943975-33-5 | Methyl 2-bromo-4-chloro-6-fluorobenzoate

AG01FPL3

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CAS Number	943975-33-5
Catalog Number	AG01FPL3(AGN-PC-3H5P10)
Chemical Name	Methyl 2-bromo-4-chloro-6-fluorobenzoate
IUPAC Name	methyl 2-bromo-4-chloro-6-fluorobenzoate
InChI	InChI=1S/C8H5BrClFO2/c1-13-8(12)7-5(9)2-4(10)3-6(7)11/h2-3H,1H3
InChI Key	ZHDQAVDNSOHLEO-UHFFFAOYSA-N
MDL Number	MFCD28733924
Molecular Formula	C8H5BrClFO2
Molecular Weight	267.4795
SMILES	BrC1=C(C(=O)OC)C(=CC(=C1)Cl)F
Synonyms	Methyl 2-bromo-4-chloro-6-fluorobenzoate, 943975-33-5, AS-64407, CS-0098703,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.91455g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	267.48g/mol
Monoisotopic Mass	265.91455g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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