AG007WSE

1040377-08-9 | 1-(2-(tetrahydro-2H-pyran-2-yloxy)ethyl)-1H-4-pyrazole boronic acid pinacol ester

AG007WSE

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CAS Number	1040377-08-9
Catalog Number	AG007WSE(AGN-PC-0OSTVG)
Chemical Name	1-(2-(tetrahydro-2H-pyran-2-yloxy)ethyl)-1H-4-pyrazole boronic acid pinacol ester
IUPAC Name	2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethanol
InChI	InChI=1S/C11H19BN2O3/c1-10(2)11(3,4)17-12(16-10)9-7-13-14(8-9)5-6-15/h7-8,15H,5-6H2,1-4H3
InChI Key	QEHDAUWYRNEWBF-UHFFFAOYSA-N
MDL Number	MFCD12033564
Molecular Formula	C11H19BN2O3
Molecular Weight	238.0912
SMILES	CC1(C)OB(OC1(C)C)C1=CN(CCO)N=C1
Synonyms	1040377-08-9, 2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)ethanol, 2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]ethan-1-ol, AK-78028, 1-(2-HYDROXYETHYL)-1H-PYRAZOLE-4-BORONIC ACID PINACOL ESTER, 1-(HYDROXYETHYL)PYRAZOLE-4-BORONIC ACID PINACOL ESTER, 2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]ethan-1-ol, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-1-ETHANOL, 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)ethan-1-ol, 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]ethanol, QEHDAUWYRNEWBF-UHFFFAOYSA-N, PubChem22670, SCHEMBL20759, AMBA00031, CTK8B6918, DTXSID00671779, CS-D1545, KS-000007NI, ZX-AT014097, ANW-54820, MFCD12033564, AKOS015945123, ZINC169745973, AM62742, FCH2844950, OR51738, PB29947, DS-17272, SY006739, AX8220112, DB-059086, TC-143565, 4CH-011028, FT-0655648, ST24021736, Z3834, MFCD12033564 (95%), Q-2174, [1-(2-HYDROXYETHYL)PYRAZOL-4-YL]BORONIC ACID PINACOL ESTER, 2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethanol, 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethanol, 1-Hydroxy-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]ethane, 1H-Pyrazole-1-ethanol, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazol-1-yl);ethanol, 2-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyrazol-1-yl]-ethanol, C11H19BN2O3, N-(2-hydroxyethyl)pyrazole boronate, 1-(2-(tetrahydro-2H-pyran-2-yloxy)ethyl)-1H-4-pyrazole boronic acid pinacol ester,

Complexity	270
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.149g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	238.094g/mol
Monoisotopic Mass	238.149g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	56.5A^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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