AG006CBZ

956388-05-9 | 1-(Tetrahydro-2h-pyran-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indazole

AG006CBZ

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CAS Number	956388-05-9
Catalog Number	AG006CBZ(AGN-PC-0D0GRD)
Chemical Name	1-(Tetrahydro-2h-pyran-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indazole
IUPAC Name	1-(oxan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole
InChI	InChI=1S/C18H25BN2O3/c1-17(2)18(3,4)24-19(23-17)14-8-7-9-15-13(14)12-20-21(15)16-10-5-6-11-22-16/h7-9,12,16H,5-6,10-11H2,1-4H3
InChI Key	NWAGHQGLQLEDIZ-UHFFFAOYSA-N
MDL Number	MFCD18207194
Molecular Formula	C18H25BN2O3
Molecular Weight	328.2137
SMILES	CC1(C)OB(OC1(C)C)C1=C2C=NN(C3CCCCO3)C2=CC=C1
Synonyms	956388-05-9, 1-(Tetrahydropyran-2-yl)-4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)-1H-indazole, 1-(tetrahydro-2H-pyran-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole, 1-(oxan-2-yl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole, (1-(Tetrahydro-2H-pyran-2-yl)-1H-indazol-4-yl)boronic acid pinacol ester, 1-(Tetrahydro-pyran-2-yl)-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-indazole, A1-01867, 1-(TETRAHYDRO-2H-PYRAN-2-YL)-1H-INDAZOLE-4-BORONIC ACID PINACOL ESTER, 1-(Tetrahydropyran-2-yl)-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-indazole, SCHEMBL138511, CTK8B8020, DTXSID00732450, NWAGHQGLQLEDIZ-UHFFFAOYSA-N, BCP14227, CS-M0441, 6494AC, ANW-59196, MFCD18207194, QC-169, AKOS016002312, PB13787, KS-0000072D, AK-43802, AS-51252, AB0094826, AX8211390, TC-147941, Q-2317, 1-(Oxan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole, 1-(Tetrahydropyran-2-yl);-4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl);-1H-indazole, C18H25BN2O3,

Complexity	457
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	328.196g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	328.219g/mol
Monoisotopic Mass	328.196g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.5A^2
Undefined Atom Stereocenter Count	1
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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