1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid
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1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid
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CAS No:
175277-09-5
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Formula:
C9H14N2O2
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Chemical Name:
1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid
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Synonyms:
2-tert-butyl-5-methylpyrazole-3-carboxylic acid;
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CAS No:
1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid Basic Attributes
182.22000
182.105527694
DTXSID00372537
2933199090
Characteristics
55.12000
1.64470
1.13g/cm3
149ºC
313.9ºC
143.7ºC
1.533
17.2 [ug/mL]
0.000204mmHg at 25°C
Computed Properties
Molecular Weight:182.22
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:182.105527694
Monoisotopic Mass:182.105527694
Topological Polar Surface Area:55.1
Heavy Atom Count:13
Complexity:210
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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