(S)-(−)-Citronellic acid
ALDRICH/364428 - 98%
Synonym: (S)-(−)-3,7-Dimethyl-6-octenoic acid
CAS Number: 2111-53-7
Empirical Formula (Hill Notation): C10H18O2
Molecular Weight: 170.25
MDL Number: MFCD00134278
Linear Formula: (CH3)2C=CHCH2CH2CH(CH3)CH2CO2H
Product Type: Chemical
| assay | 98% |
| bp | 115-120 °C/0.4 mmHg (lit.) |
| density | 0.926 g/mL at 25 °C (lit.) |
| form | liquid |
| functional group | carboxylic acid |
| InChI | 1S/C10H18O2/c1-8(2)5-4-6- |
| InChI key | GJWSUKYXUMVMGX-VIFPVBQESA |
| optical activity | [α]25/D −8°, neat |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | C[C@@H](CCC=C(/C)C)CC(O) |
| Application: | (S)-(-)-Citronellic acid may be used in the synthesis of trisubstituted piperidine substructures of the veratramine and jervine type, that can be building blocks for developing cyclopamine analogs. |
| Packaging: | 1 g in glass bottle |
| Symbol |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315 |
| Hazard Codes | Xi |
| Risk Statements | 38 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | > 235.4 °F - closed cup |
| Flash Point(C) | > 113 °C - closed cup |
| Purity | 98% |
| bp | 115-120 °C/0.4 mmHg (lit.) |
| Density | 0.926 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352002 |