tert-butyl pyrazole-1-carboxylate
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tert-butyl pyrazole-1-carboxylate
structure -
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CAS No:
219580-32-2
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Formula:
C8H12N2O2
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Chemical Name:
tert-butyl pyrazole-1-carboxylate
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Synonyms:
N-Boc-pyrazole; 1-N-Boc-pyrazole; 1-Boc-pyrazole; Tert-Butyl 1H-pyrazole-1-carboxylate; 1H-Pyrazole,N1-BOC protected; 1H-Pyrazole-1-carboxylic acid,1,1-dimethylethyl ester;Expand
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CAS No:
tert-butyl pyrazole-1-carboxylate Basic Attributes
168.19300
168.089877630
DTXSID00561045
2933199090
Safety Information
Xi; Xn
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:168.19
XLogP3:1.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:168.089877630
Monoisotopic Mass:168.089877630
Topological Polar Surface Area:44.1
Heavy Atom Count:12
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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