{4-[(2,2-Dimethylpropoxy)sulfonyl]phenyl}boronic acid
[CAS# 957060-74-1]

Identification

• Name: {4-[(2,2-Dimethylpropoxy)sulfonyl]phenyl}boronic acid
• Synonyms: (4-((Neopentyloxy)sulfonyl)phenyl)boronic acid; 2,2-(Dimethylprop-1-yl) 4-boronobenzenesulfonate; 4-(neopentyloxysulfonyl)phenylboronic acid
• Molecular Formula: C₁₁H₁₇BO₅S
• Molecular Weight: 272.13
• CAS Registry Number: 957060-74-1
• SMILES: B(c1ccc(cc1)S(=O)(=O)OCC(C)(C)C)(O)O
• InChI: 1S/C11H17BO5S/c1-11(2,3)8-17-18(15,16)10-6-4-9(5-7-10)12(13)14/h4-7,13-14H,8H2,1-3H3
• InChIKey: HDSWCPUGAFITCT-UHFFFAOYSA-N

Properties

• Density: 1.264g/cm³ (Cal.)
• Boiling point: 426.052°C at 760 mmHg (Cal.)
• Flash point: 211.469°C (Cal.)
• Refractive index: 1.535 (Cal.)

Safety Data

• Safety Description: IRRITANT