AG000O7F

1256360-46-9 | 1-Tosyl-1,2,3,6-tetrahydropyridine-4-boronic acid, pinacol ester

AG000O7F

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CAS Number	1256360-46-9
Catalog Number	AG000O7F(AGN-PC-09PZNS)
Chemical Name	1-Tosyl-1,2,3,6-tetrahydropyridine-4-boronic acid, pinacol ester
IUPAC Name	1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine
InChI	InChI=1S/C18H26BNO4S/c1-14-6-8-16(9-7-14)25(21,22)20-12-10-15(11-13-20)19-23-17(2,3)18(4,5)24-19/h6-10H,11-13H2,1-5H3
InChI Key	HSUXBKSAYIKGHM-UHFFFAOYSA-N
MDL Number	MFCD17926518
Molecular Formula	C18H26BNO4S
Molecular Weight	363.2793
SMILES	O=S(N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1)(C3=CC=C(C)C=C3)=O
Synonyms	1256360-46-9, 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1,2,3,6-tetrahydropyridine, 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-1-(toluene-4-sulfonyl)-1,2,3,6-tetrahydro-pyridine, 1-tosyl-1,2,3,6-tetrahydropyridine-4-boronic acid, pinacol ester, Pyridine, 1,2,3,6-tetrahydro-1-[(4-methylphenyl)sulfonyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, CTK8B6900, DTXSID20682367, ANW-54787, MFCD17926518, AKOS016001172, ZINC169747542, AM80920, AM85065, AK-96333, DS-18068, ST2405355, 4CH-018864, CS-0029523, B-2890, 1-Tosyl-1,2,3,6-tetrahydropyridine-4-boronic acid,pinacol ester, (1-TOSYL-1,2,3,6-TETRAHYDROPYRIDIN-4-YL)BORONIC ACID PINACOL ESTER, 1-(4-Methylbenzene-1-sulfonyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine, 1-[(4-Methylphenyl)sulfonyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine, HSUXBKSAYIKGHM-UHFFFAOYSA-N, ACN-046451, 1-Tosyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,

Complexity	614
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	363.168g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	363.279g/mol
Monoisotopic Mass	363.168g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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