4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid
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4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid
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CAS No:
71173-77-8
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Formula:
C4H4N2O3
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Chemical Name:
4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid
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Synonyms:
1H-Pyrazole-3-carboxylic acid,4,5-dihydro-5-oxo-;2-Pyrazoline-3-carboxylic acid,5-oxo-;4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid
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CAS No:
4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid Basic Attributes
128.08600
128.09
DTXSID0072277
2933199090
Safety Information
|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.
4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid Use and Manufacturing
1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-: INACTIVE
Computed Properties
Molecular Weight:128.09
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:128.02219199
Monoisotopic Mass:128.02219199
Topological Polar Surface Area:78.8
Heavy Atom Count:9
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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