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CAS Number: 765948-78-5
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one

Structure

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one
Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one
Synonyms:
General Information
Product Number: 765948785
CAS Registry Number:
765948-78-5
name:
1H-Isoindol-1-one, 2,3-dihydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-isoindolinone; 4-(4,4,5,5-Tetramethyl[1,3,2]dioxaborolan-2-yl)-2,3-dihydroisoindol-1-one 
 
Chemical Formula: C14H18BNO3
Exact Mass: 259.14
Molecular Weight: 259.11
m/z: 259.14 (100.0%), 258.14 (23.9%), 260.14 (15.3%), 261.14 (1.7%)
Elemental Analysis: C, 64.90; H, 7.00; B, 4.17; N, 5.41; O, 18.52
 
InChI: InChI=1S/C14H18BNO3/c1-13(2)14(3,4)19-15(18-13)11-7-5-6-9-10(11)8-16-12(9)17/h5-7H,8H2,1-4H3,(H,16,17)
InChIKey: CXNFLUANJNYFBF-UHFFFAOYSA-N
Canonical SMILES : B1(OC(C(O1)(C)C)(C)C)C2=C3CNC(=O)C3=CC=C2
 
 
Thermal Properties Value Condition Note
Melting Point 189-191 °C Solv: hexane (110-54-3) (1)CAS

Specification

98%

References
  1. (1) Matulenko, Mark; US 20110275630 A1 2011 CAPLUS
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