AG003EO3

340-07-8 | 1-Trifluoroacetyl Piperidine

AG003EO3

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CAS Number	340-07-8
Catalog Number	AG003EO3(AGN-PC-0WA4UR)
Chemical Name	1-Trifluoroacetyl Piperidine
IUPAC Name	2,2,2-trifluoro-1-piperidin-1-ylethanone
InChI	InChI=1S/C7H10F3NO/c8-7(9,10)6(12)11-4-2-1-3-5-11/h1-5H2
InChI Key	BCJUMGSHTLYECD-UHFFFAOYSA-N
MDL Number	MFCD00466213
Molecular Formula	C7H10F3NO
Molecular Weight	181.1556
SMILES	O=C(N1CCCCC1)C(F)(F)F
Synonyms	1-Trifluoroacetyl piperidine, 340-07-8, 1-(Trifluoroacetyl)piperidine, N-trifluoroacetylpiperidine, 2,2,2-trifluoro-1-(piperidin-1-yl)ethanone, N-Trifluoroacetyl Piperidine, 2,2,2-trifluoro-1-(1-piperidinyl)ethanone, PubChem8042, AC1NPN5Q, 1-TrifluoroacetylPiperidine, ACMC-20ap99, N-(trifluoroacetyl)piperidine, SCHEMBL766324, CTK8C6236, DTXSID50409226, BCJUMGSHTLYECD-UHFFFAOYSA-N, 1-Trifluoroacetyl piperidine, 97%, ZINC3165531, 5159AJ, MFCD00466213, AKOS011781173, TRA0008210, KS-00000B54, AS-31826, SC-03596, 2,2,2-trifluoro-1-piperidin-1-ylethanone, AB0063112, TC-172404, FT-0653135, K-7805, 2,2,2-tris(fluoranyl)-1-piperidin-1-yl-ethanone, A822040, I12-0181, C7H10F3NO, CID5181830, 2,2,2-trifluoro-1-(1-piperidyl)ethanone, T2087, 1-Trifluoroacetyl piperidine, 97% - 1G 1g,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.071g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	181.158g/mol
Monoisotopic Mass	181.071g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H300-H319-H400
Packing Group	Ⅲ
Precautionary statements	P264-P273-P301+P310-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

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