1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID
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1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID
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CAS No:
852362-22-2
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Formula:
C10H11BN2O2
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Chemical Name:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID
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Synonyms:
AKOS BRN-0254;1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID;1-BENZYL-1H-PYRAZOL-4-YLBORONIC ACID;1-BENZYL-4-1H-PYRAZOLEBORONIC ACID;1H-PYRAZOLE-1-BENZYL-4-BORONIC ACID;1H-Pyrazole-benzyl-4-boronic acid;1-Benzyl-1H-pyrazol-4-boronic acid;1-(Phenylmethyl)-1H-pyrazole-4-boronic acid, 1-Benzyl-4-borono-1H-pyrazole
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CAS No:
Characteristics
58.3
-0.38880
White solid
1.2±0.1 g/cm3
76-81℃
438.4ºC at 760 mmHg
219.0±29.3 °C
1.580
2-8°C
Safety Information
IRRITANT
NONH for all modes of transport
3
Xi
Irritant
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:202.02
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:202.0913578
Monoisotopic Mass:202.0913578
Topological Polar Surface Area:58.3
Heavy Atom Count:15
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID
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