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4-ISOXAZOLEBORONICACIDPINACOLESTER

4-ISOXAZOLEBORONICACIDPINACOLESTER structure

CAS No:
928664-98-6
Formula:
C9H14BNO3
Chemical Name:
4-ISOXAZOLEBORONICACIDPINACOLESTER
Synonyms:
4-ISOXAZOLEBORONIC ACID PINACOL ESTER;4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)isoxazole;3-Hydroxy-2,3-diMethylbutan-2-yl hydrogen 1,2-oxazol-4-ylboronate;ISOXAZOL-4-YLBORONIC ACID PINACOL ESTER;3-hydroxy-2,3-dimethylbutan-2-yl hydrogen isoxazol-4-ylboronate;Isoxazole-4-boronic acid pinacol ester;Isoxazole-boronic acid pinacol ester;3-hydroxy-2,3-dimethylbutan-2-yl hydrogen isoxazol-4-y
Categories:
Organic Chemistry > Coordination Complexes

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4-ISOXAZOLEBORONICACIDPINACOLESTER Basic Attributes

Molecular Weight：

195.02

Exact Mass：

195.1066735

DSSTox ID：

DTXSID50585938

Characteristics

Density：

1.08±0.1 g/cm3

Melting Point：

110-115℃

Boiling Point：

289.9±13.0 °C(Predicted)

PKA：

-2.02±0.50

Safety Information

wgk germany：

hazard class code：

20/21/22

Marks：

GHS Classification：

|Warning|H302 (92.68%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 41 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:195.03
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:195.1066735
Monoisotopic Mass:195.1066735
Topological Polar Surface Area:44.5
Heavy Atom Count:14
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 928664-98-6

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4-Isoxazoleboronic acid pinacol ester

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CAS No.: 928664-98-6

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Guide of 4-ISOXAZOLEBORONICACIDPINACOLESTER

Basic Attributes
Characteristics
Safety Information
Computed Properties
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