3,5-DI-TERT-BUTYL-1H-PYRAZOLE
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3,5-DI-TERT-BUTYL-1H-PYRAZOLE
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CAS No:
1132-14-5
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Formula:
C11H20N2
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Chemical Name:
3,5-DI-TERT-BUTYL-1H-PYRAZOLE
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Synonyms:
3,5-di-tert-butyl-1H-pyrazole;3,5-Di-t-butylpyrazole;3,5-Ditert-butyl-1H-pyrazole;1H-Pyrazole,3,5-bis(1,1-dimethylethyl)-;1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-;3,5-di-tert-butylpyrazole;SCHEMBL1205789;SCHEMBL13935866;CTK4A8149;DTXSID80150315
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CAS No:
Characteristics
28.7
3.00470
0.927±0.06 g/cm3(Predicted)
191-192 °C
255.3±9.0 °C(Predicted)
95.5ºC
1.483
0.0264mmHg at 25°C
Safety Information
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|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:180.29
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:180.162648646
Monoisotopic Mass:180.162648646
Topological Polar Surface Area:28.7
Heavy Atom Count:13
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes