4B7X5VPT9A structure

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

CAS: 36047-55-9
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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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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