4-PHENOXYPHENYLACETICACID
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4-PHENOXYPHENYLACETICACID
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CAS No:
6328-74-1
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Formula:
C14H12O3
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Chemical Name:
4-PHENOXYPHENYLACETICACID
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Synonyms:
NSC 43857;RARECHEM AL BO 1521;4-PHENOXYPHENYLACETIC;4-PHENOXYPHENYLACETIC ACID;4-Phenoxybenzeneacetic Acid;4-Phenoxyphenylethanoic acid;p-Phenyloxyphenylacetic Acid;4-Phenoxyphenylacetic acid 97%;2-(4-PHENOXYPHENYL)ACETIC ACID;4-(Carboxymethyl)diphenyl ether
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CAS No:
Safety Information
UN 3077 9/PG 3
2
R22
S60-S61
Xn,N,Xi
P273-P280-P305 + P351 + P338
H302-H317-H318-H400
|Danger|H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-PHENOXYPHENYLACETICACID Use and Manufacturing
1 N-NaOH aqueous solution (7.8 mL) was added to an ethanol (20 mL) solution of methyl 4-phenoxyphenylacetate (948 mg, 3.9 mmol), and stirred for 5 hours at room temperature. The reaction solution was concentrated under reduced pressure, and 1 N hydrochloric acid aqueous solution (10 mL) was added. The precipitated white solid was filtered out and washed successively with water and ether to obtain 4-phenoxyphenylacetic acid (813 mg, 91percent) as a white solid. LC-MS 229 [M+H]EXAMPLE 8
4-PHENOXYPHENYLACETIC ACID is an arylaliphatic acid used in the preperation of protential inhibitors of collagen-induced aggregation of human thrombocytes. p-Phenyloxyphenylacetic Acid is a predicted metabolite of 6-Amino-4-(4-phenoxyphenylethylamino)quinazoline.
Computed Properties
Molecular Weight:228.24
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:228.078644241
Monoisotopic Mass:228.078644241
Topological Polar Surface Area:46.5
Heavy Atom Count:17
Complexity:238
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes