AG0035XU

4629-04-3 | Stearoylpiperidide

AG0035XU

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CAS Number	4629-04-3
Catalog Number	AG0035XU(AGN-PC-0N2FHZ)
Chemical Name	Stearoylpiperidide
IUPAC Name	1-piperidin-1-yloctadecan-1-one
InChI	InChI=1S/C23H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23(25)24-21-18-16-19-22-24/h2-22H2,1H3
InChI Key	MFZHIRGDMBVSTF-UHFFFAOYSA-N
MDL Number	MFCD00293058
Molecular Formula	C23H45NO
Molecular Weight	351.6095
SMILES	CCCCCCCCCCCCCCCCCC(N1CCCCC1)=O
Synonyms	1-(Piperidin-1-yl)octadecan-1-one, 4629-04-3, Stearoylpiperidide, stearic acid piperidide, Piperidine, 1-stearoyl-, 1-Piperidino-1-octadecanone, SCHEMBL19061150, MFZHIRGDMBVSTF-UHFFFAOYSA-N, Piperidine, 1-(1-oxooctadecyl)-, 1-Octadecanone, 1-(1-piperidinyl)-, AKOS030525239, 1-(1-piperidyl)octadecan-1-one, CID10315969,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	351.35g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	351.619g/mol
Monoisotopic Mass	351.35g/mol
Rotatable Bond Count	16
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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