Shell SD-5090
1-(4-chlorophenyl)ethyl (E)-3-diethoxyphosphoryloxybut-2-enoate
Also Known As: Shell SD-5090|ENT 25,512|Phosphoric acid, 1-(p-chloro-alpha-methylbenzyloxycarbonyl)-1-propen-2-yl diethyl ester|Crotonic acid, 3-hydroxy-, p-chloro-alpha-methylbenzyl ester, diethyl phosphate|1-(4-chlorophenyl)ethyl (E)-3-diethoxyphosphoryloxybut-2-enoate|1-(4-chlorophenyl)ethyl 3-[(diethoxyphosphoryl)oxy]but-2-enoate|[1-(4-Chloro-alpha-methylbenzyloxycarbonyl)-1-propen-2-yl]diethyl=phosphate|2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, 1-(4-chlorophenyl)ethyl ester
| Molecular Formula | C16H22ClO6P |
|---|---|
| Molecular Weight | 376.08426 g/mol |
| LogP | 5.0457 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 376.08426 |
| Monoisotopic Mass | 376.08426 |
| Heavy Atoms | 24 |
| Complexity | 603.4986 |
Chemical Identifiers
| CAS Number | 64050-67-5 |
|---|---|
| SMILES | CCOP(=O)(OCC)O/C(=C/C(=O)OC(C)C1=CC=C(C=C1)Cl)/C |
Product Overview
Shell SD-5090 (CAS 64050-67-5), with molecular formula C16H22ClO6P and molecular weight 376.08426 g/mol. IUPAC: 1-(4-chlorophenyl)ethyl (E)-3-diethoxyphosphoryloxybut-2-enoate.
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