AG003DKH

4629-80-5 | 1,3-dimethylpiperidin-4-one

AG003DKH

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CAS Number	4629-80-5
Catalog Number	AG003DKH(AGN-PC-0JLFU9)
Chemical Name	1,3-dimethylpiperidin-4-one
EC Number	225-046-0
IUPAC Name	1,3-dimethylpiperidin-4-one
InChI	InChI=1S/C7H13NO/c1-6-5-8(2)4-3-7(6)9/h6H,3-5H2,1-2H3
InChI Key	BGDGMIWDPMJYPP-UHFFFAOYSA-N
MDL Number	MFCD00100893
Molecular Formula	C7H13NO
Molecular Weight	127.1842
SMILES	O=C1C(C)CN(C)CC1
Synonyms	1,3-Dimethylpiperidin-4-one, 4629-80-5, 1,3-Dimethyl-4-piperidone, 1,3-Dimethyl-piperidin-4-one, 4-Piperidinone, 1,3-dimethyl-, 1,3-Dimthylpiperidin-4-one, BGDGMIWDPMJYPP-UHFFFAOYSA-N, 1,3-Dimethyl-4-piperidinone, EINECS 225-046-0, ZERO/001491, zlchem 321, PubChem14069, ACMC-209k6l, AC1L31WM, AC1Q2RB5, AC1Q6ER7, KSC495I6L, 1,3-dimethylpiperidine-4-one, 1,3-Dimethyl-4-oxopiperidine, SCHEMBL1476498, 1,3-Dimethyl-4-piperidinone #, CTK3J5465, KS-00000DOZ, ZLC0155, 1527494-96-7, 1527494-98-9, ACT05241, BCP06571, CS-M1154, STR03969, ANW-30427, CD0222, MFCD00100893, SBB001724, STK676403, AKOS004122933, AKOS016347369, AB03409, AC-6515, AN-9940, CM11117, LS40400, MCULE-2657347941, RP19752, TRA0035148, 1,3-dimethyl-4-piperidone, AldrichCPR, AK-31130, AS-17334, BC208022, BR-31130, SC-21048, SY009715, U608, AB0006548, DB-070723, RT-002534, ST2408463, ST4054521, 4CH-001790, AM20120623, C2943, D3909, FT-0606691, FT-0629999, EN300-60127, M-3478, MFCD00100893 (97+%), I12-0366, W-106095, F0908-3964, Z969563034, Tetrabenzyl diphosphate, C7H13NO, 4-Piperidone, 1,3-dimethyl-, C7-H13-N-O, KST-1B4526, Pyrophosphoric acid tetrabenzyl ester, (3R)-1,3-dimethylpiperidin-4-one, (3S)-1,3-dimethylpiperidin-4-one, AR-1B7069, CID107311, ACN-001635, 4956-11-0,

Complexity	122
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	127.1g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	127.187g/mol
Monoisotopic Mass	127.1g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H227-H315-H319-H335
Precuationary statements	P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number