Methyl 1H-pyrazole-3-carboxylate
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Methyl 1H-pyrazole-3-carboxylate
structure -
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CAS No:
15366-34-4
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Formula:
C5H6N2O2
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Chemical Name:
Methyl 1H-pyrazole-3-carboxylate
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Synonyms:
Methyl 1H-Pyrazole-3-Carboxylate; Methyl Pyrazole-3-carboxylate; methyl 1H-pyrazole-5-carboxylate; Pyrazole-3-carboxylic Acid Methyl Ester;
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CAS No:
Methyl 1H-pyrazole-3-carboxylate Basic Attributes
126.11300
126.042927438 g/mol
DTXSID10340565
2933199090
Characteristics
54.98000
0.19630
1.275g/cm3
141-142ºC
271.1ºC at 760mmHg
117.8ºC
1.53
0.00657mmHg at 25°C
Safety Information
R36/37/38
S22
Xi
|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 4 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:126.11
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:126.042927438
Monoisotopic Mass:126.042927438
Topological Polar Surface Area:55
Heavy Atom Count:9
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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