1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
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1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
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CAS No:
108444-25-3
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Formula:
C13H14N2O2
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Chemical Name:
1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
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Synonyms:
1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID;1-(benzyl)-3,5-dimethyl-pyrazole-4-carboxylic acid;3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid;3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxylic acid
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CAS No:
1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID Basic Attributes
230.26
230.10600
DTXSID20385109
2933199090
Safety Information
IRRITANT
22-36
26
Xi,Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:230.26
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:230.105527694
Monoisotopic Mass:230.105527694
Topological Polar Surface Area:55.1
Heavy Atom Count:17
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
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CN
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1-BENZYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
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