1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
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1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
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CAS No:
245035-74-9
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Formula:
C12H11ClN2O2
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Chemical Name:
1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
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Synonyms:
2-[(4-chlorophenyl)methyl]-5-methylpyrazole-3-carboxylic acid;1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID;SCHEMBL6258641;DTXSID10401983;ZINC2520649;AKOS022555538;MCULE-1300105945
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CAS No:
1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID Basic Attributes
250.68
250.051
DTXSID10401983
2933199090
Safety Information
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:250.68
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:250.0509053
Monoisotopic Mass:250.0509053
Topological Polar Surface Area:55.1
Heavy Atom Count:17
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-(4-CHLOROBENZYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
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