AG007PL8

120800-05-7 | 1-(5,6-Dichloropyridin-3-yl)ethan-1-one

AG007PL8

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CAS Number	120800-05-7
Catalog Number	AG007PL8(AGN-PC-0N0FVV)
Chemical Name	1-(5,6-Dichloropyridin-3-yl)ethan-1-one
IUPAC Name	1-(5,6-dichloropyridin-3-yl)ethanone
InChI	InChI=1S/C7H5Cl2NO/c1-4(11)5-2-6(8)7(9)10-3-5/h2-3H,1H3
InChI Key	XTLLDYXVYZYXRX-UHFFFAOYSA-N
MDL Number	MFCD09879710
Molecular Formula	C7H5Cl2NO
Molecular Weight	190.0267
SMILES	CC(C1=CC(Cl)=C(Cl)N=C1)=O
Synonyms	120800-05-7, 1-(5,6-dichloropyridin-3-yl)ethanone, Ethanone, 1-(5,6-dichloro-3-pyridinyl)-, 1-(5,6-DICHLOROPYRIDIN-3-YL)ETHAN-1-ONE, 1-(5,6-dichloro-pyridin-3-yl)-ethanone, ACMC-20mp4s, 2,3-dichloro-5-acetylpyridine, SCHEMBL2421365, CTK0C3710, KS-00000TIR, DTXSID50436638, XTLLDYXVYZYXRX-UHFFFAOYSA-N, MFCD10697703, ZINC95093602, 1-(5,6-dichloro-3-pyridyl)ethanone, AKOS006303173, 5-ACETYL-2,3-DICHLOROPYRIDINE, AB60291, EH-0711, 1(5,6-dichloro-pyridin-3-yl)-ethanone, AK232478, CID10198006,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.975g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	190.023g/mol
Monoisotopic Mass	188.975g/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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