AG00GUAE

879648-22-3 | 4,4,5,5-Tetramethyl-2-(2-(methylsulfonyl)phenyl)-1,3,2-dioxaborolane

AG00GUAE

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CAS Number	879648-22-3
Catalog Number	AG00GUAE(AGN-PC-09T3MU)
Chemical Name	4,4,5,5-Tetramethyl-2-(2-(methylsulfonyl)phenyl)-1,3,2-dioxaborolane
IUPAC Name	4,4,5,5-tetramethyl-2-(2-methylsulfonylphenyl)-1,3,2-dioxaborolane
InChI	InChI=1S/C13H19BO4S/c1-12(2)13(3,4)18-14(17-12)10-8-6-7-9-11(10)19(5,15)16/h6-9H,1-5H3
InChI Key	FGHAQXOPLXCRFH-UHFFFAOYSA-N
MDL Number	MFCD14584689
Molecular Formula	C13H19BO4S
Molecular Weight	282.1636
SMILES	O=S(C1=CC=CC=C1B2OC(C)(C)C(C)(C)O2)(C)=O
Synonyms	879648-22-3, 4,4,5,5-TETRAMETHYL-2-(2-(METHYLSULFONYL)PHENYL)-1,3,2-DIOXABOROLANE, AK-39271, 4,4,5,5-Tetramethyl-2-[2-(methylsulfonyl)phenyl]-1,3,2-dioxaborolane, SCHEMBL14258661, DTXSID40700092, FGHAQXOPLXCRFH-UHFFFAOYSA-N, CS-B1258, MFCD14584689, ZINC170022552, FCH2815628, DS-13117, SC-70832, AX8163897, DB-011248, FT-0756742, 2-(methylsulfonyl)phenylboronic acid pinacol ester, (2-(METHYLSULFONYL)PHENYL)BORONIC ACID PINACOL ESTER, 2-[2-(Methanesulfonyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, ACN-044124,

Complexity	422
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282.11g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	282.161g/mol
Monoisotopic Mass	282.11g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	61A^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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