AG003DKI

1046832-21-6 | 1,3-Dimethyl-1H-Pyrazole-4-Boronic Acid,Pinacol Ester

AG003DKI

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CAS Number	1046832-21-6
Catalog Number	AG003DKI(AGN-PC-0WA442)
Chemical Name	1,3-Dimethyl-1H-Pyrazole-4-Boronic Acid,Pinacol Ester
IUPAC Name	1,3-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChI	InChI=1S/C11H19BN2O2/c1-8-9(7-14(6)13-8)12-15-10(2,3)11(4,5)16-12/h7H,1-6H3
InChI Key	FBNAMBTYMSWTIB-UHFFFAOYSA-N
MDL Number	MFCD09864190
Molecular Formula	C11H19BN2O2
Molecular Weight	222.0918
SMILES	CC1(C)C(C)(C)OB(C2=CN(C)N=C2C)O1
Synonyms	1046832-21-6, 1,3-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, 1,3-DIMETHYL-1H-PYRAZOLE-4-BORONIC ACID,PINACOL ESTER, 1,3-dimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, 1,3-DIMETHYLPYRAZOLE-4-BORONIC ACID PINACOL ESTER, FBNAMBTYMSWTIB-UHFFFAOYSA-N, 1,3-dimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole, MFCD09864190, 1,3-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole, PubChem23961, SCHEMBL520778, 1,3-Dimethyl-1H-pyrazole-4-boronic acid pinacol ester, CTK8B3411, DTXSID10655323, KS-000003RD, ANW-42481, SBB019226, STK695192, AKOS005606580, ZINC169743798, CS-W000814, GS-5763, MCULE-1125231987, PB23707, QC-4903, RTR-001024, VB10486, NCGC00338642-01, AK-38135, AM802869, BC000034, SC-28399, SY023482, AB0091229, TR-001024, 4CH-010123, D5184, FT-0727897, ST24026762, A22106, C-2067, AB01330642-02, MFCD09864190 (97+%), J-503913, 1,3-Dimethyl-1H-pyrazole-4-boronic acid, pinacol ester, 1,3-Dimethylpyrazole-4-boronic acid pinacol ester, 97%, 1H-Pyrazole,1,3-dimethyl-4-(4,4,5,5-tetramethyl-1,, (1,3-DIMETHYL-1H-PYRAZOL-4-YL)BORONIC ACID PINACOL ESTER, 2-(1,3-Dimethyl-4-pyrazolyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 2-(1,3-dimethylpyrazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 1,3-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-PYRAZOLE, 1,3-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole, 1H-PYRAZOLE, 1,3-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-, 1H-Pyrazole,1,3-dimethyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-, ACN-032689, 1,3-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, 95% - 1G 1g,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.154g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.095g/mol
Monoisotopic Mass	222.154g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	36.3A^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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