CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colourless or pale straw-coloured liquid; Warm-herbaceous, slightly woody and discretely medicinal-camphoraceous odour of moderate to poor tenacity |
|---|---|
| Boiling Point | 221.00 to 222.00 °C. @ 760.00 mm Hg |
| Solubility | Insoluble in water and propylene glycol; soluble in oils |
| Density | 0.976-0.983 |
| LogP | 3.220 |
| Refractive Index | 1.490-1.500 |
| Kovats Retention Index | 1212.8 1198 1204 1193 1196 1237 1202 1192 1195 1202.9 1193 1196 1196 1194 1194 1196 1194 1194 1195 1242 1214 1199.4 1201.3 1202.1 1191 1195 1194 1193 1194 1203 1195 1194 1198 1197 1218 1202 1194 1194 1196 1196 1196 1160 1194 1199 1194 1204 1196 1194 1194 1206 1206 1192 1193 1191 1191 1191 1191 1198 1187 1189 1193 1182 1189 1194 1195 1194 1191 1194 1191 1191 1195 1194 1206 1201 1191 1193 1194 1190 1152 1191 1201 1194 1208 1197 1207 1191 1196 1202 1209 1214 1196 1200 1202 1195 1199 1192 1201 1201 1196 1206 1195 1194 1194 1196 1207 1196 1191 1194 1196 1196 1190 1197 1170 1198 1198 1200 1197 1170 1196 1194 1196 1192 1196 1195.1 1169 1170 1198 1194 1208 1181 1181 1196 1198 1194 1198 1198 1196 1194 1196 1196 1194 1195 1197 1198 1195 1193 1188 1202 1202 1196 1200 1195 1200 1194 1193 1216 1197 1165 1192 1196 1203 1198 1195 1212 1176 1199 1191 1195 1196 1203 1196 1194 1224 1194 1179 1194 1197 1194 1195 1194 1194 1194 1178 1179 1194 1194 1193 1194 1188.3 1194 1201 1189 1198 1194 1196 1195 1194 1195 1150 1194 1194 1191 1192 1191 |
COMPUTED DESCRIPTORS
| Molecular Weight | 152.23 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 152.120115130 g/mol |
| Monoisotopic Mass | 152.120115130 g/mol |
| Topological Polar Surface Area | 20.2 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 203 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Myrtenol is a natural product found in Xylopia aromatica, Xylopia sericea, and other organisms with data available.