4-Nitrophenylboronic acid pinacol ester
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4-Nitrophenylboronic acid pinacol ester
structure -
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CAS No:
171364-83-3
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Formula:
C12H16BNO4
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Chemical Name:
4-Nitrophenylboronic acid pinacol ester
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Synonyms:
4-NITROPHENYLBORONIC ACID PINACOL ESTER;4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)NITROBENZENE;4-Nitrobenzeneboronic acid, pinacol ester;4,4,5,5-tetramethyl-2-(4-nitrophenyl)-1,3,2-dioxaborolane;2-(4-Nitrophenyl)-4,4,5,5,-tetramethyl-1,3,2-dioxaborolane, 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)nitrobenzene;-Nitrophenylboronic acid pinacol ester;1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-(4-nitrophenyl)-;4-Nitrophenylboronic acid pinacol ester4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)nitrobenzene
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CAS No:
Characteristics
64.3
2.41720
1.14±0.1 g/cm3(Predicted)
112-116 °C(lit.)
357.5±25.0 °C(Predicted)
170.0±23.2 °C
1.516
Slightly soluble in water.
StoreCold
5.58E-05mmHg at 25°C
Safety Information
IRRITANT
2
36/37/38
26-36
Xi
Harmful/Store Cold
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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 41 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:249.07
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:249.1172382
Monoisotopic Mass:249.1172382
Topological Polar Surface Area:64.3
Heavy Atom Count:18
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Nitrophenylboronic acid pinacol ester
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