Diethyl (5-methylhexa-1,3,4-trien-3-yl)phosphonate

Base Information

• Chemical Name: Diethyl (5-methylhexa-1,3,4-trien-3-yl)phosphonate
• CAS No.: 17167-19-0
• Molecular Formula: C₁₁H₁₉O₃P
• Molecular Weight: 230.244
• DSSTox Substance ID: DTXSID40501182
• Mol file: 17167-19-0.mol

Synonyms:17167-19-0;DTXSID40501182;diethyl 3-methyl-1-vinyl-1,2-butadienylphosphonate;Diethyl (5-methylhexa-1,3,4-trien-3-yl)phosphonate

Chemical Property of Diethyl (5-methylhexa-1,3,4-trien-3-yl)phosphonate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 230.10718146
• Heavy Atom Count: 15
• Complexity: 311

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MSDS Files:

Useful:

• Canonical SMILES: CCOP(=O)(C(=C=C(C)C)C=C)OCC

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