AG0031CF

308087-58-3 | Ethanone, 1-(4-methylene-1-piperidinyl)-

AG0031CF

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CAS Number	308087-58-3
Catalog Number	AG0031CF(AGN-PC-0KL78E)
Chemical Name	Ethanone, 1-(4-methylene-1-piperidinyl)-
IUPAC Name	1-(4-methylidenepiperidin-1-yl)ethanone
InChI	InChI=1S/C8H13NO/c1-7-3-5-9(6-4-7)8(2)10/h1,3-6H2,2H3
InChI Key	SCRVAOXFSUATBN-UHFFFAOYSA-N
MDL Number	MFCD00831797
Molecular Formula	C8H13NO
Molecular Weight	139.1949
SMILES	CC(N1CCC(CC1)=C)=O
Synonyms	308087-58-3, 1-Acetyl-4-methylenepiperidine, 1-(4-Methylenepiperidin-1-yl)ethanone, 1-(4-methylidenepiperidino)ethan-1-one, 1-(4-methylidenepiperidin-1-yl)ethanone, Ethanone, 1-(4-methylene-1-piperidinyl)-, AC1MDSAR, SCHEMBL1066347, CTK1C0177, DTXSID80383505, ZINC163661, Piperidine, 1-acetyl-4-methylene-, 1-Acetyl-4-methylenepiperidine 97%, 5044AJ, MFCD00831797, AKOS022183152, AJ-16057, SY008656, DB-017766, TC-306641, FT-0703786, MFCD00831797 (97+%), C8H13NO, ZINC00163661, CID2794962, 107165-67-3,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	139.1g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	139.198g/mol
Monoisotopic Mass	139.1g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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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