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Structure

(4-Isocyanatophenyl)boronic acid,pinacol ester

CAS
380430-64-8
Catalog Number
ACM380430648
Category
Other Products
Molecular Weight
245.08
Molecular Formula
C13H16BNO3

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Specification

Synonyms
AmbitBD974, MolPort-001-759-511, CID2773474, (4-Isocyanatophenyl)boronic acid pinacol ester, 2-(4-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 380430-64-8
IUPAC Name
2-(4-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N=C=O
InChI Key
RHKRIDVZGAXYQE-UHFFFAOYSA-N
Boiling Point
100-105ºC 2mm
Melting Point
162-168ºC
Flash Point
154.4ºC
Density
1.05g/cm³
Exact Mass
245.12200
Hazard Statements
C,T
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
26-28-36/37/39
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