2-(3,5-dimethylpyrazol-1-yl)benzoic acid
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2-(3,5-dimethylpyrazol-1-yl)benzoic acid
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CAS No:
27363-77-5
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Formula:
C12H12N2O2
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Chemical Name:
2-(3,5-dimethylpyrazol-1-yl)benzoic acid
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Synonyms:
2-(3,5-dimethyl-pyrazol-1-yl)-benzoic acid; 2-(3,5-Dimethyl-1H-pyrazol-1-yl)benzoic acid; o-(3,5-Dimethyl-1-pyrazol)-benzoesaeure;
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CAS No:
Safety Information
Xi
|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:216.24
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:216.089877630
Monoisotopic Mass:216.089877630
Topological Polar Surface Area:55.1
Heavy Atom Count:16
Complexity:270
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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