[2-(3,4-dimethylanilino)-2-oxoethyl] prop-2-ynoate
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![[2-(3,4-dimethylanilino)-2-oxoethyl] prop-2-ynoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8940deb000c34a0a8e6c610297edc655.png "[2-(3,4-dimethylanilino)-2-oxoethyl] prop-2-ynoate")
[2-(3,4-dimethylanilino)-2-oxoethyl] prop-2-ynoate
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CAS No:
784171-87-5
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Formula:
C13H13NO3
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Chemical Name:
[2-(3,4-dimethylanilino)-2-oxoethyl] prop-2-ynoate
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Synonyms:
HMS1717P02;ZINC2656156;AKOS034470411;MCULE-4282438068;[(3,4-dimethylphenyl)carbamoyl]methyl prop-2-ynoate;Z57014392;784171-87-5
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CAS No:
Computed Properties
Molecular Weight:231.25
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:231.08954328
Monoisotopic Mass:231.08954328
Topological Polar Surface Area:55.4
Heavy Atom Count:17
Complexity:342
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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