1,3-Dioxan-5-ol, 2-(2,6-dimethyl-1,5-heptadienyl)-

Base Information

• Chemical Name: 1,3-Dioxan-5-ol, 2-(2,6-dimethyl-1,5-heptadienyl)-
• CAS No.: 4740-81-2
• Molecular Formula: C13H22O3
• Molecular Weight: 226.31198
• European Community (EC) Number: 225-251-5
• DSSTox Substance ID: DTXSID3063590
• Nikkaji Number: J262.424I
• Mol file: 4740-81-2.mol

Synonyms:4740-81-2;EINECS 225-251-5;1,3-Dioxan-5-ol, 2-(2,6-dimethyl-1,5-heptadienyl)-;2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxan-5-ol;1,3-Dioxan-5-ol, 2-(2,6-dimethyl-1,5-heptadien-1-yl)-;SCHEMBL6254150;DTXSID3063590;2-(2,6-Dimethyl-1,5-heptadienyl)-1,3-dioxan-5-ol

Chemical Property of 1,3-Dioxan-5-ol, 2-(2,6-dimethyl-1,5-heptadienyl)-

Chemical Property:

• Vapor Pressure: 1.18E-05mmHg at 25°C
• Boiling Point: 330.8°C at 760 mmHg
• Flash Point: 153.9°C
• PSA: 0.00000
• Density: 1.059g/cm³
• LogP: 0.00000
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 226.15689456
• Heavy Atom Count: 16
• Complexity: 256

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(=CCCC(=CC1OCC(CO1)O)C)C
• Isomeric SMILES: CC(=CCC/C(=C/C1OCC(CO1)O)/C)C

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