4B7X5VPT9A
methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2λ5-oxazaphospholidin-2-yl)oxy]pent-3-enoate
Also Known As: Methyl 2,2,4-trimethyl-3-((3-methyl-2-sulfido-1,3,2-oxazaphospholidin-2-yl)oxy)-3-pentenoate|methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2|methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2lambda5-|3-Pentenoic acid, 2,2,4-trimethyl-3-[[(3-methyl-2-sulfido-1,3,2-oxazaphospholidin-1-yl)phosphinothioyl]oxy]-, methyl ester|methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2|E5-oxazaphospholidin-2-yl)oxy]pent-3-enoate|Methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2lambda5-oxazaphospholidin-2-yl)oxy]pent-3-enoate|methyl 2,2,4-trimethyl-3-[(3-methyl-2-thioxo-1,3,2$l^{5}-oxazaphospholidin-2-yl)oxy]pent-3-enoate
| Molecular Formula | C12H22NO4PS |
|---|---|
| Molecular Weight | 307.1007 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 80.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.1007 |
| Monoisotopic Mass | 307.1007 |
| Heavy Atoms | 19 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 36047-55-9 |
|---|---|
| SMILES | CC(=C(C(C)(C)C(=O)OC)OP1(=S)N(CCO1)C)C |
| InChIKey | AQITXJZTINNGPN-UHFFFAOYSA-N |
Product Overview
4B7X5VPT9A (CAS 36047-55-9), with molecular formula C12H22NO4PS and molecular weight 307.1007 g/mol. IUPAC: methyl 2,2,4-trimethyl-3-[(3-methyl-2-sulfanylidene-1,3,2λ5-oxazaphospholidin-2-yl)oxy]pent-3-enoate.
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