AG00946U

1203500-13-3 | (E)-2-Chloro-5-methylnicotinaldehyde oxime

AG00946U

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CAS Number	1203500-13-3
Catalog Number	AG00946U(AGN-PC-0WA2DX)
Chemical Name	(E)-2-Chloro-5-methylnicotinaldehyde oxime
IUPAC Name	(NE)-N-[(2-chloro-5-methylpyridin-3-yl)methylidene]hydroxylamine
InChI	InChI=1S/C7H7ClN2O/c1-5-2-6(4-10-11)7(8)9-3-5/h2-4,11H,1H3/b10-4+
InChI Key	MGXHHVLUUMAQPZ-ONNFQVAWSA-N
MDL Number	MFCD13563057
Molecular Formula	C7H7ClN2O
Molecular Weight	170.5963
SMILES	Cc1cc(/C=N/O)c(nc1)Cl
Synonyms	(E)-2-Chloro-5-methylnicotinaldehyde oxime, 1203500-13-3, AC1Q2OG2, MFCD13563057, AKOS006336474, AJ-101518, TR-070627, Z8221, A-6214, (E)-2-Chloro-5-methylnicotinaldehyde oxime, AldrichCPR, (E)-N-[(2-chloro-5-methylpyridin-3-yl)methylidene]hydroxylamine, C7H7ClN2O,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	170.025g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.596g/mol
Monoisotopic Mass	170.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H301
Packing Group
Precautionary statements	P301+P310
UN Code	\N

Certificate of Analysis

Lot Number