AG01ALKQ

1214325-32-2 | METHYL 3-BROMO-2-FLUOROPYRIDINE-4-CARBOXYLATE

AG01ALKQ

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CAS Number	1214325-32-2
Catalog Number	AG01ALKQ
Chemical Name	METHYL 3-BROMO-2-FLUOROPYRIDINE-4-CARBOXYLATE
IUPAC Name	methyl 3-bromo-2-fluoropyridine-4-carboxylate
InChI	InChI=1S/C7H5BrFNO2/c1-12-7(11)4-2-3-10-6(9)5(4)8/h2-3H,1H3
InChI Key	JBQRECAJGREBGX-UHFFFAOYSA-N
MDL Number	MFCD14698115
Molecular Formula	C7H5BrFNO2
Molecular Weight	234.0225
SMILES	O=C(C1=C(Br)C(F)=NC=C1)OC
Synonyms	1214325-32-2, methyl 3-bromo-2-fluoropyridine-4-carboxylate, Methyl 3-bromo-2-fluoroisonicotinate, ZINC47202526, methyl 3-bromo-2-fluoro-4-pyridinecarboxylate,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.949g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.024g/mol
Monoisotopic Mass	232.949g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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