AG003UNN

273203-62-6 | Tetradecyl nicotinate

AG003UNN

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CAS Number	273203-62-6
Catalog Number	AG003UNN(AGN-PC-0JSFWJ)
Chemical Name	Tetradecyl nicotinate
IUPAC Name	tetradecyl pyridine-3-carboxylate
InChI	InChI=1S/C20H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-23-20(22)19-15-14-16-21-18-19/h14-16,18H,2-13,17H2,1H3
InChI Key	TVGLGJWCZSCAEM-UHFFFAOYSA-N
MDL Number	MFCD16620608
Molecular Formula	C20H33NO2
Molecular Weight	319.4815
SMILES	O=C(OCCCCCCCCCCCCCC)C1=CN=CC=C1
UNII	8QWM6I035C
Synonyms	myristyl nicotinate, Tetradecyl nicotinate, Myristyl nicotinate, 273203-62-6, Myristylnicotinate, UNII-8QWM6I035C, 3-Pyridinecarboxylic acid, tetradecyl ester, 8QWM6I035C, tetradecyl pyridine-3-carboxylate, AK158385, C20H33NO2, Nicotinic acid, tetradecyl ester, tetradecylnicotinate, AC1LB91I, AC1Q67DQ, Tetradecan-1-ol, nicotinate, Nicotinic acid myristyl ester, SCHEMBL135491, CTK4F9474, KS-00000BST, DTXSID30181770, TVGLGJWCZSCAEM-UHFFFAOYSA-N, 7362AJ, MFCD16620608, ZINC43153333, AKOS024258483, DS-9346, EBD3046909, TRA0083995, BC600076, DA-42952, SY025969, AX8166903, TX-012452, 4CH-000761, FT-0738775, ST24050124, MFCD16620608 (97%), MYRISTYL NICOTINATE; 3-PYRIDINECARBOXYLIC ACID, TETRADECYL ESTER, AR-1J6944, CID531641, 27486-78-8,

Complexity	281
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	319.251g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	319.489g/mol
Monoisotopic Mass	319.251g/mol
Rotatable Bond Count	15
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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