1-(3-Phenoxyphenyl)prop-2-yn-1-yl 2-(4-chlorophenyl)-3-methylbutanoate
1-(3-phenoxyphenyl)prop-2-ynyl 2-(4-chlorophenyl)-3-methylbutanoate
Also Known As: S-5655|S 5655|1-(3-Phenoxyphenyl)prop-2-yn-1-yl 2-(4-chlorophenyl)-3-methylbutanoate|Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, ethynyl(3-phenoxyphenyl)methyl ester|1-(3-phenoxyphenyl)prop-2-ynyl 2-(4-chlorophenyl)-3-methylbutanoate|Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, 1-(3-phenoxyphenyl)-2-propynyl ester|2-(4-Chlorophenyl)-3-methylbutanoic acid alpha-ethynyl-3-phenoxybenzyl ester|4-Chloro-alpha-(1-methylethyl)benzeneacetic acid 1-(3-phenoxyphenyl)-2-propynyl ester
| Molecular Formula | C26H23ClO3 |
|---|---|
| Molecular Weight | 418.13358 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.13358 |
| Monoisotopic Mass | 418.13358 |
| Heavy Atoms | 30 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 57731-67-6 |
|---|---|
| SMILES | CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#C)C2=CC(=CC=C2)OC3=CC=CC=C3 |
| InChIKey | XETLICAXPDNIOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Phenoxyphenyl)prop-2-yn-1-yl 2-(4-chlorophenyl)-3-methylbutanoate (CAS 57731-67-6), with molecular formula C26H23ClO3 and molecular weight 418.13358 g/mol. IUPAC: 1-(3-phenoxyphenyl)prop-2-ynyl 2-(4-chlorophenyl)-3-methylbutanoate.
1-(3-Phenoxyphenyl)prop-2-yn-1-yl 2-(4-chlorophenyl)-3-methylbutanoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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