CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Kovats Retention Index | 1125 1118.7 1119.8 1120.4 1129 1118 1129 1121 1121 1122 1123 1117 1118 1128 1117 1117 1116 1114 1129 1118 1138 1116 1118 1116 1133 1135 1120 1134 1151 1130.9 1131.9 1134.3 1110 1142 1122 1117 1110 1120 1110 1115 1120 1112 1116 1126 1110 1117 1113 1142 1111 1116 1118 1134 1130 1101 1118 1130 1130 1101 1110 1110 1119 |
| Chemical Classes | Other Classes -> Aliphatics, Unsaturated |
COMPUTED DESCRIPTORS
| Molecular Weight | 136.23 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 2 |
| Exact Mass | 136.125200510 g/mol |
| Monoisotopic Mass | 136.125200510 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 165 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
(4E,6E)-2,6-dimethylocta-2,4,6-triene is an ocimene that consists of octa-2,4,6-triene bearing methyl substituents at positions 2 and 6 (the 4E,6E-isomer). It has a role as a semiochemical.