AG0036G8

797755-07-8 | Phenylacetic acid-4-boronic acid pinacol ester

AG0036G8

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CAS Number	797755-07-8
Catalog Number	AG0036G8(AGN-PC-0KZ3SX)
Chemical Name	Phenylacetic acid-4-boronic acid pinacol ester
IUPAC Name	2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetic acid
InChI	InChI=1S/C14H19BO4/c1-13(2)14(3,4)19-15(18-13)11-7-5-10(6-8-11)9-12(16)17/h5-8H,9H2,1-4H3,(H,16,17)
InChI Key	FNLWHBHWDXCWHV-UHFFFAOYSA-N
MDL Number	MFCD04038755
Molecular Formula	C14H19BO4
Molecular Weight	262.1093
SMILES	OC(CC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)=O
Synonyms	797755-07-8, 2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetic acid, 4-(Carboxymethyl)phenylboronic acid pinacol ester, Phenylacetic acid-4-boronic acid pinacol ester, AK-84287, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYLACETATE, [4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetic acid, 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetic Acid, BENZENEACETIC ACID, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-, 4-(Carboxymethyl)phenylboronic acid pinacol ester, 97%, (4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetic acid, AC1MW61U, SCHEMBL182576, CTK8B4026, KS-00000GWR, DTXSID70395470, FNLWHBHWDXCWHV-UHFFFAOYSA-N, ZXBA000613, ANW-43719, MFCD04038755, AKOS004911596, ZINC169743567, AB17191, ACN-032735, AM90128, CA-1188, CS-W000969, FCH2718805, LS10861, RTR-025301, DS-17407, OR360010, AX8147618, TR-025301, BB 0261672, FT-0676997, B-4299, 4-(Carboxymethyl)phenylboronic acidpinacol ester, 4-(Dihydroxyborane)phenylacetic acid pinacol ester, 4-(Carboxymethyl)phenylboronic acid pinacol ester, 95%, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylacetic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaboro-lan-2-yl)phenylacetic acid, CID3719002, 4-Acetoxyphenylboronic acid pinacol ester, 4-(Carboxymethyl)phenylboronic acid, pinacol ester, 480424-70-2,

Complexity	329
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.138g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	262.112g/mol
Monoisotopic Mass	262.138g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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