4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid
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4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid
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CAS No:
84547-85-3
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Formula:
C5H5ClN2O2
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Chemical Name:
4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid
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Synonyms:
1H-Pyrazole-3-carboxylic acid,4-chloro-1-methyl-;4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid
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CAS No:
4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid Basic Attributes
160.56
160.56
DTXSID10344144
2933199090
Characteristics
55.1
0.77170
1.56g/cm3
219-221 °C @ Solvent: Acetic acid
327ºC at 760 mmHg
151.6ºC
1.62
Safety Information
IRRITANT
P264, P280, P305+P351+P338, P33, P313
H319
|Warning|H319 (95%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:160.56
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:160.0039551
Monoisotopic Mass:160.0039551
Topological Polar Surface Area:55.1
Heavy Atom Count:10
Complexity:153
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid
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