3-(1-Imidazolyl)benzoic Acid
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3-(1-Imidazolyl)benzoic Acid
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CAS No:
108035-47-8
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Formula:
C10H8N2O2
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Chemical Name:
3-(1-Imidazolyl)benzoic Acid
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Synonyms:
3-(1H-Imidazol-1-yl)benzoic acid; 3-imidazol-1-ylbenzoic acid;
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CAS No:
Characteristics
55.12000
1.57050
white crystal powder
1.28g/cm3
194ºC
427.6ºC
212.4ºC
1.631
4.5E-08mmHg at 25°C
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:188.18
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:188.058577502
Monoisotopic Mass:188.058577502
Topological Polar Surface Area:55.1
Heavy Atom Count:14
Complexity:220
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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