AG00G4JB

760990-10-1 | 3-Amino-4-hydroxyphenylboronic acid pinacol ester

AG00G4JB

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CAS Number	760990-10-1
Catalog Number	AG00G4JB(AGN-PC-07XTDP)
Chemical Name	3-Amino-4-hydroxyphenylboronic acid pinacol ester
IUPAC Name	2-amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI	InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)8-5-6-10(15)9(14)7-8/h5-7,15H,14H2,1-4H3
InChI Key	RXHWPAXQYXTPJB-UHFFFAOYSA-N
MDL Number	MFCD13176535
Molecular Formula	C12H18BNO3
Molecular Weight	235.0872
SMILES	OC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1N
Synonyms	760990-10-1, 3-Amino-4-hydroxyphenylboronic acid pinacol ester, 2-Amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol, 3-Amino-4-hydroxyphenylboronic acid pinacol ester, 95%, 3-Amino-4-hydroxyphenylboronic acid, pinacol ester, SCHEMBL4813256, DTXSID20674181, RXHWPAXQYXTPJB-UHFFFAOYSA-N, ZXBA000658, MFCD13176535, AKOS015960309, ZINC169743556, FCH2719297, MB12339, BC000521, OR360644, CS-0088570, A-3718, 3-Amino-4-hydroxyphenylboronic acid pinacol ester, AldrichCPR, 2-amino-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenol,

Complexity	280
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.138g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	235.09g/mol
Monoisotopic Mass	235.138g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	64.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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