4-(1H-imidazol-1-ylmethyl)benzoicacid
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4-(1H-imidazol-1-ylmethyl)benzoicacid
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CAS No:
94084-75-0
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Formula:
C11H10N2O2
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Chemical Name:
4-(1H-imidazol-1-ylmethyl)benzoicacid
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Synonyms:
4-(1H-imidazol-1-ylmethyl)benzoic acid;4-(1H-Imidazole-1-ylmethyl)benzoic acid;OKY-070;4-(4-(1H-imidazol-1-ylmethyl)benzoic acid;4-(Imidazol-1-ylmethyl)benzoic acid;Benzoic acid, 4-(1H-imidazol-1-ylmethyl)-
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CAS No:
Characteristics
1.24±0.1 g/cm3
267-268 °C(Solv: methanol (67-56-1); water (7732-18-5))
441.4±28.0 °C(Predicted)
4.14±0.10
Safety Information
|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:202.21
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:202.074227566
Monoisotopic Mass:202.074227566
Topological Polar Surface Area:55.1
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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