3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI)
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3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI)
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CAS No:
100047-66-3
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Formula:
C6H6N2O3
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Chemical Name:
3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI)
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Synonyms:
1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid;1-Methyl-6-oxo-1,6-dihydro-pyridazine-3-carboxylic acid;1-methyl-6-oxopyridazine-3-carboxylic acid;3-pyridazinecarboxylic acid,1,6-dihydro-1-methyl-6-oxo-;1-methyl-6-oxohydropyridazine-3-carboxylic acid;SCHEMBL286957;3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI);KS-000003LT;ZINC3249589;7070AC
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CAS No:
3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI) Basic Attributes
154.124
154.03800
DTXSID60368279
2933990090
Characteristics
72.19000
-0.6
1.44±0.1 g/cm3(Predicted)
239 °C(Solv: water (7732-18-5))
316.5±25.0 °C(Predicted)
145.2ºC
1.608
8.73E-05mmHg at 25°C
Safety Information
NONH for all modes of transport
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:154.12
XLogP3:-0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:154.03784206
Monoisotopic Mass:154.03784206
Topological Polar Surface Area:70
Heavy Atom Count:11
Complexity:267
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Pyridazinecarboxylicacid,1,6-dihydro-1-methyl-6-oxo-(6CI)
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