AG00CAYY

4045-27-6 | 1-acetyl-3-piperidinol

AG00CAYY

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CAS Number	4045-27-6
Catalog Number	AG00CAYY(AGN-PC-03HD78)
Chemical Name	1-acetyl-3-piperidinol
IUPAC Name	1-(3-hydroxypiperidin-1-yl)ethanone
InChI	InChI=1S/C7H13NO2/c1-6(9)8-4-2-3-7(10)5-8/h7,10H,2-5H2,1H3
InChI Key	HTFMTRPNNXNQRN-UHFFFAOYSA-N
MDL Number	MFCD12179758
Molecular Formula	C7H13NO2
Molecular Weight	143.1836
SMILES	CC(N1CC(O)CCC1)=O
Synonyms	4045-27-6, 1-(3-hydroxypiperidin-1-yl)ethanone, 1-Acetyl-3-hydroxy-piperidine, 3-Piperidinol, 1-acetyl-, 1-ACETYL-3-PIPERIDINOL, 1-acetylpiperidin-3-ol, N-acetyl-3-hydroxypiperidine, 1-[(3S)-3-hydroxypiperidin-1-yl]ethanone, 1-Acetyl-3-hydroxypiperidine, SCHEMBL3606966, CTK1D4552, DTXSID40619635, HTFMTRPNNXNQRN-UHFFFAOYSA-N, 1-acetyl-3-piperidinol(SALTDATA, ALBB-018596, 1-Acetyl-3-piperidinol, AldrichCPR, 2724AE, MFCD12179758, AKOS009126486, MCULE-4557043332, 1-(3-Hydroxy-piperidin-1-yl)-ethanone, 1-(3-Hydroxypiperidin-1-yl)ethan-1-one, 1-[(3R)-3-hydroxypiperidin-1-yl]ethanone, AB0086227, ST2401732, CS-0069665, FT-0766628, Y-7078, C7H13NO2, 1-((R)-3-Hydroxy-piperidin-1-yl)-ethanone, 1-((S)-3-Hydroxy-piperidin-1-yl)-ethanone, 1-Acetyl-3-hydroxy-piperidine, 98% - 1G 1g, 1126736-22-8, 732245-90-8,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.095g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.186g/mol
Monoisotopic Mass	143.095g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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