3-Nitrophenylboronic acid
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3-Nitrophenylboronic acid
structure -
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CAS No:
13331-27-6
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Formula:
C6H6BNO4
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Chemical Name:
3-Nitrophenylboronic acid
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Synonyms:
Boronic acid,B-(3-nitrophenyl)-;Benzeneboronic acid,m-nitro-;Boronic acid,(3-nitrophenyl)-;B-(3-Nitrophenyl)boronic acid;m-Nitrobenzeneboronic acid;3-Nitrobenzeneboronic acid;m-Nitrophenylboronic acid;3-Nitrophenylboronic acid;NSC 401539;NSC 59739
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CAS No:
3-Nitrophenylboronic acid Basic Attributes
166.93
166.93
2938638
JLC765W4PN
401539|59739
DTXSID2065416
29310095
Characteristics
86.3
-0.20220
Light yellow to pale brown Powder
1.40±0.1 g/cm3(Predicted)
282-286 °C
363.3±44.0 °C(Predicted)
173.5±28.4 °C
1.574
soluble in hot water
0-6°C
6.5E-06mmHg at 25°C
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-37/39-36
CY8980000
Xi
Harmful
Stable under normal temperatures and pressures.
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-Nitrophenylboronic acid Use and Manufacturing
suzuki reaction
Boronic acid, B-(3-nitrophenyl)-: INACTIVE
Computed Properties
Molecular Weight:166.93
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:167.0389878
Monoisotopic Mass:167.0389878
Topological Polar Surface Area:86.3
Heavy Atom Count:12
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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