3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid
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![3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/67ef91d92ad34a009e363b0bd0fe001a.png "3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid")
3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid
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CAS No:
101756-25-6
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Formula:
C13H16O4
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Chemical Name:
3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid
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Synonyms:
101756-25-6;3-[1-(4-methylphenyl)propoxy]-3-oxopropanoic acid;AF 450;alpha-Ethyl-p-methylbenzyl ester of malonic acid;MALONIC ACID, MONO(alpha-ETHYL-p-METHYLBENZYL) ESTER;ACMC-20m4rp;Propanedioic acid,1-[1-(4-methylphenyl)propyl] ester;DTXSID20906590;AF-450
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CAS No:
Computed Properties
Molecular Weight:236.26
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:236.10485899
Monoisotopic Mass:236.10485899
Topological Polar Surface Area:63.6
Heavy Atom Count:17
Complexity:267
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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