2,4-DiMethyl-2H-pyrazole-3-carboxylic acid
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2,4-DiMethyl-2H-pyrazole-3-carboxylic acid
structure -
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CAS No:
13745-58-9
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Formula:
C6H8N2O2
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Chemical Name:
2,4-DiMethyl-2H-pyrazole-3-carboxylic acid
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Synonyms:
1,4-dimethyl-1H-pyrazole-5-carboxylic acid;2,4-dimethylpyrazole-3-carboxylic acid;2,4-Dimethyl-2H-pyrazole-3-carboxylic acid;1H-pyrazole-5-carboxylic acid, 1,4-dimethyl-;SCHEMBL2212203;DTXSID90349117;9632AH;MFCD19228349;STL415407;ZINC32302989
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CAS No:
2,4-DiMethyl-2H-pyrazole-3-carboxylic acid Basic Attributes
140.13992
140.059
-0
DTXSID90349117
2933199090
Characteristics
55.1
0.5
1.28±0.1 g/cm3(Predicted)
171 °C(Solv: water (7732-18-5))
305.4±22.0 °C(Predicted)
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:140.14
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:140.058577502
Monoisotopic Mass:140.058577502
Topological Polar Surface Area:55.1
Heavy Atom Count:10
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,4-DiMethyl-2H-pyrazole-3-carboxylic acid
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