AG007LPM

138647-49-1 | 1(2H)-Pyridinecarboxylicacid, 3,6-dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester

AG007LPM

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CAS Number	138647-49-1
Catalog Number	AG007LPM(AGN-PC-0PN2M7)
Chemical Name	1(2H)-Pyridinecarboxylicacid, 3,6-dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylate
InChI	InChI=1S/C11H16F3NO5S/c1-10(2,3)19-9(16)15-6-4-8(5-7-15)20-21(17,18)11(12,13)14/h4H,5-7H2,1-3H3
InChI Key	WUBVEMGCQRSBBT-UHFFFAOYSA-N
MDL Number	MFCD09997858
Molecular Formula	C11H16F3NO5S
Molecular Weight	331.3086
SMILES	C(=O)(OC(C)(C)C)N1CCC(=CC1)OS(=O)(=O)C(F)(F)F
Synonyms	138647-49-1, tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate, 1-(tert-Butoxycarbonyl)-1,2,3,6-tetrahydropyridin-4-yl trifluoromethanesulfonate, 1-(tert-Butoxycarbonyl)-1,2,3,6-tetrahydropyridin-4-yl-trifluoromethanesulfonate, N-Boc-4-Trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine, Tert-butyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylate, tert-butyl 4-(trifluoromethylsulfonyloxy)-5,6-dihydropyridine-1(2H)-carboxylate, 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester, 1(2H)-Pyridinecarboxylicacid, 3,6-dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester, 1-(tert-Butoxycarbonyl)-1,2,3,6-tetrahydropyridin-4-yltrifluoromethanesulfonate, 4-TRIFLUOROMETHANESULFONYLOXY-3,6-DIHYDRO-2H-PYRIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, tert-butyl 4-[(trifluoromethane)sulfonyloxy]-1,2,3,6-tetrahydropyridine-1-carboxylate, J-503636, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydro-1(2H)-pyridinecarboxylate, tert-butyl 4-(((trifluoromethyl)sulfonyl)oxy)-3,6-dihydro-1(2H)-pyridinecarboxylate, tert-butyl 4-(((trifluoromethyl)sulfonyl)oxy)-3,6-dihydropyridine-1(2H)-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine-1(2H)-carboxylate, tert-Butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-5,6-dihydropyridine-1(2H)-carboxylate, WUBVEMGCQRSBBT-UHFFFAOYSA-N, 3,6-dihydro-4-(((trifluoromethyl)sulfonyl)oxy)-1(2h)-pyridinecarboxylic acid tert-butyl ester, 3,6-Dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-1(2H)-pyridinecarboxylic acid tert-butyl ester, ACMC-20efyq, PubChem20998, SCHEMBL212403, CTK4C1340, DTXSID90451067, KS-000024EW, ZX-RL000872, CT0165, MFCD09997858, ZINC59796855, AKOS005762919, DH-0724, FCH1627567, PB13226, QC-2644, AC-24257, AK-33210, AN-31855, BR-33210, SC-26423, AB0047696, AB1006486, DB-012858, RT-014328, ST2419949, TL8000883, 4CH-013274, AM20080286, FT-0648131, A-6756, EN300-118350, 647B491, A807413, AS-813/40188733, 1-(tertbutoxycarbonyl)-1,2,3,6-tetrahydropyridin-4, 1-boc-4-trifluoromethylsulfonyloxy-3,4-didehydropiperidine, 1-(Boc)-1,2,3,6-Tetrahydropyridin-4-yl-trifluoromethanesulfonate, 1-boc-1,2,3,6-tetrahydro-4-[(trifluoromethyl)-sulfonyloxy]pyridine, 1-Boc-1,2,3,6-tetrahydro-4-[(trifluoromethyl)sulfonyloxy]pyridine, n-boc-4-(trifluoromethanesulfonyloxy)-1,2,3,6-tetrahydropyridine, 1-BOC-4-(TRIFLUOROMETHANESULFONYLOXY)-3,6-DIHYDRO-2H-PYRIDINE, 1-t-butoxycarbonyl-4-trifluoromethanesulfonyloxy-1,2,3,6-tetrahydropyridine, 1-t-Butoxycarbonyl-4-trifluoromethansulfonyloxy-1,2,3,6-tetrahydropyridine, 1-t-butoxycarbonyl-4-trifluoromethylsulfonyloxy-1,2,3,6-tetrahydropyridine, 1,1-dimethylethyl 4-(((trifluoromethyl)sulfonyl)oxy)-3,6-dihydropyridine-1(2H)-carboxylate, 1,1-dimethylethyl 4-(trifluoromethanesulfonyloxy)-1,2,3,6-tetrahydropyridine-1-carboxylate, 1,1-dimethylethyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydro-1(2H)-pyridinecarboxylate, 1-(t-butoxycarbonyl)-4-(trifluoromethyl sulfonyloxy)-1,2,3,6-tetrahydropyridine, 1-(tert-Butoxycarbonyl)-4-(trifluoromethylsulfonyloxy)-1,2,3,6-tetrahydropyridine, 1-(tert-butoxycarbonyl)-4-[(trifluoromethanesulfonyl)oxy]-1,2,3,6-tetrahydropyridine, 1-(tertbutoxycarbonyl)-1,2,3,6-tetrahydropyridin-4-yltrifluoromethanesulfonate, 1-tert-butoxycarbonyl-4-trifluoromethanesulfonyloxy-1,2,3,6-tetrahydropyridine, 1-tert-butoxycarbonyl-4-trifluoromethanesulfonyloxy-1,2,5,6-tetrahydropyridine, 1-tert-butyloxycarbonyl-4-trifluoromethylsulfonyloxy-1,2,5,6-tetrahydropyridine, 4-(trifluoromethanesulfonyloxy)-1-(tert-butoxycarbonyl)-1,2,5,6-tetrahydropyridine, 4-(trifluoromethanesulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-(trifluoromethanesulphonyloxy)-1-tert-butoxycarbonyl-1,2,3,6-tetrahydropyridine, 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-[(Trifluoromethylsulfonyl)oxy]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-trifluoro methanesulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-trifluoromethane sulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-trifluoromethane-sulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, 4-Trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-1 carboxylic acid tert-butyl ester, 4-trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid t-butyl ester, 4-Trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-1carboxylic acid tert-butyl ester, 4-Trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-l-carboxylic acid tert-butyl ester, 4-trifluoromethylsulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert.-butyl ester, t-butyl 4-(trifluoromethylsulfonyloxy)-5,6-dihydropyridine-1(2H)-carboxylate, t-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine-1(2H)-carboxylate, t-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6dihydropyridine-1(2h)-carboxylate, t-butyl-1,2,3,6-tetrahydro-4-(trifluoromethylsulfonyloxy)-pyridine-1-carboxylate, tert-butyl 1,2,3,6-tetrahydro-4-(trifluoromethylsulphonyloxy)-pyridine-1-carboxylate, tert-butyl 1,2,3,6-tetrahydro-4-[(trifluoromethyl)sulfonyloxy]pyridine-1-carboxylate, tert-butyl 4 {[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetrahydro-1-pyridinecarboxylate, Tert-Butyl 4-([(Trifluoromethyl)Sulfonyl]OXY}-1,2,3,6-Tetra-Hydro-1Pyridinecarboxylate, tert-butyl 4-(trifluoromethanesulfonyloxy)-1,2,3,6-tetrahydropyridine-1-carboxylate, tert-butyl 4-(trifluoromethanesulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylate, tert-butyl 4-(trifluoromethylsul-fonyloxy)-5,6-dihydropyridine-1(2H)-carboxylate, tert-butyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-1(2H)-pyridinecarboxylate, Tert-butyl 4-(trifluoromethylsulfonyloxy)-5,6-dihydropyridin-1(2H)-carboxylate, tert-Butyl 4-[(trifluoromethanesulfonyl)oxy]-3,6-dihydropyridine-1(2H)-carboxylate, tert-butyl 4-[(trifluoromethyl)sulfonyl]oxy-3,6-dihydropyridine-1(2H)-carboxylate, tert-butyl 4-{[(trifluoromethyl) sulfonyl]oxy}-1,2,3,6-tetra-hydro-1-pyridinecarboxylate, tert-butyl 4-{[(trifluoromethyl) sulfonyl]oxy}-1,2,3,6-tetrahydro-1-pyridinecarboxylate, tert-butyl 4-{[(trifluoromethyl) sulfonyl]oxy}-3,6-dihydro-1 (2H)-pyridine carboxylate, tert-butyl 4-{[(trifluoromethyl) sulfonyl]oxy}-3,6-dihydro-1(2H)-pyridine carboxylate, tert-butyl 4-{[(trifluoromethyl)-sulfonyl]oxy}-3,6-dihydropyridine-1(2h)-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetra hydro-1-pyridine-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetra-hydro-1-pyridinecarboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetrahydro-1-pyridine-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetrahydro-1-pyridinecarboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydro-1 (2h)-pyridine carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydro-1 (2h)-pyridinecarboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydro-1(2H)-pyridine carboxylate, tert-Butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine -1(2H)-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine-1(2 H)-carboxylate, tert-butyl 4-{[(trifluoromethyl)sulfonyl]oxy}3,6-dihydro-1 (2H)-pyridinecarboxylate, tert-butyl 4-trifluoromethanesulfonyloxy-3,6-dihydro-2h-pyridine-1-carboxylate, tert-butyl 4-trifluoromethylsulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylate, tert-butyl 4-trifluoromethylsulphonyloxy-3,6-dihydro-2H-pyridine-1-carboxylate, tert-butyl 4{[(trifluoromethyl)sulfonyl]oxy}-1,2,3,6-tetrahydro-1-pyridinecarboxylate, Tert-butyl-4-{[(trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine-1(2H)-carboxylate, tert-butyl4-(trifluoromethylsulfonyloxy)-5,6-dihydropyridine-1(2H)-carboxylate, trifluoromethanesulfonic acid[1-tert-butoxycarbonyl-(1,2,3,6-tetrahydropyridin-4-yl)] ester, trifluoromethanesulfonic acid[1-tert-butoxycarbonyl-(1,2,3,6-tetrahydropyridin-4-yl)]ester, 3,6-dihydro-4-[[(trifluoromethyl)-sulfonyl]oxy]1(2 H)-pyridinecarboxylic acid 1,1-dimethylethyl ester, 3,6-Dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-1(2 H)-pyridinecarboxylic acid 1,1-dimethylethyl ester, 3,6-Dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-1(2H)-pyridinecarboxylic acid 1,1-dimethylethyl ester, 3,6-Dihydro-4[[(trifluoromethyl)sulfonyl]oxy]-1(2H)pyridinecarboxylic acid 1,1-dimethylethyl ester, 4-{[(Trifluoromethyl)sulfonyl]oxy}-3,6-dihydropyridine-1(2H)carboxylic acid tert-butyl ester, CID10991161,

Complexity	528
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	331.07g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	331.306g/mol
Monoisotopic Mass	331.07g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	81.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number