(2-Aminopyrimidin-5-yl)boronic acid
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(2-Aminopyrimidin-5-yl)boronic acid
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CAS No:
936250-22-5
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Formula:
C4H6BN3O2
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Chemical Name:
(2-Aminopyrimidin-5-yl)boronic acid
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Synonyms:
Boronic acid,B-(2-amino-5-pyrimidinyl)-;B-(2-Amino-5-pyrimidinyl)boronic acid;(2-Aminopyrimidin-5-yl)boronic acid;2-Aminopyrimidine-5-boronic acid
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CAS No:
Characteristics
92.3
-1.68020
Solid
1.4±0.1 g/cm3
>300 °C
487ºC at 760 mmHg
248.3±31.5 °C
1.590
2-8°C
Safety Information
NONH for all modes of transport
2
36/37/38
26-36/37/39
Xi
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 44 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
(2-Aminopyrimidin-5-yl)boronic acid Use and Manufacturing
By the alternative synthetic route in Scheme 8, to a 3-L flask under nitrogen was charged tetrahydrofuran (1055 mL), followed by 5-bromopyrimidine-2-amine 9 (70.0 g, 0.40 mol).
May contain variable amounts of acid anhydride.
Computed Properties
Molecular Weight:138.92
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:139.0553066
Monoisotopic Mass:139.0553066
Topological Polar Surface Area:92.3
Heavy Atom Count:10
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(2-Aminopyrimidin-5-yl)boronic acid
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