AG008AIR

886365-47-5 | 1-(5-Bromo-2-chloropyridin-3-yl)ethanone

AG008AIR

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CAS Number	886365-47-5
Catalog Number	AG008AIR(AGN-PC-051LUI)
Chemical Name	1-(5-Bromo-2-chloropyridin-3-yl)ethanone
IUPAC Name	1-(5-bromo-2-chloropyridin-3-yl)ethanone
InChI	InChI=1S/C7H5BrClNO/c1-4(11)6-2-5(8)3-10-7(6)9/h2-3H,1H3
InChI Key	SQKOULMBBLJIKX-UHFFFAOYSA-N
MDL Number	MFCD08436181
Molecular Formula	C7H5BrClNO
Molecular Weight	234.4777
SMILES	CC(C1=CC(Br)=CN=C1Cl)=O
Synonyms	1-(5-Bromo-2-chloropyridin-3-yl)ethanone, 886365-47-5, 1-(5-BROMO-2-CHLOROPYRIDIN-3-YL)ETHAN-1-ONE, 1-(5-Bromo-2-chloro-pyridin-3-yl)-ethanone, AK-67067, AC1Q1JKU, SCHEMBL1600624, CTK5G1012, DTXSID60649636, SQKOULMBBLJIKX-UHFFFAOYSA-N, 1939AF, MFCD08436181, ZINC12648931, AKOS015834453, FCH1386731, PB27914, AJ-62809, AS-43330, DA-18796, AX8207601, TC-063236, 1-(5-bromo-2-chloropyridin-3-yl)-ethanone, CS-0021075, FT-0681666, A-6674, Ethanone, 1-(5-bromo-2-chloro-3-pyridinyl)-, I14-26168, 1-(5-Bromo-2-chloropyridin-3-yl)ethanone, AldrichCPR, C7H5BrClNO,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.924g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.477g/mol
Monoisotopic Mass	232.924g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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