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| CAS No.: | 105-85-1 |
|---|---|
| Name: | Citronellolformate |
| Article Data: | 5 |
| Molecular Structure: | |
|
|
|
| Formula: | C11H20O2 |
| Molecular Weight: | 184.279 |
| Synonyms: | 6-Octen-1-ol,3,7-dimethyl-, formate (7CI,8CI,9CI);Citronellol, formate (6CI);3,7-Dimethyl-6-octen-1-ol formate;NSC 46117; |
| EINECS: | 203-338-9 |
| Density: | 0.887 g/cm3 |
| Melting Point: | -58.7°C (estimate) |
| Boiling Point: | 244.7 °C at 760 mmHg |
| Flash Point: | 95.3 °C |
| Solubility: | 16.2mg/L at 20℃ |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 26.30000 |
| LogP: | 3.56790 |
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Chemistry
IUPAC: 3,7-dimethyloct-6-enyl formate (105-85-1)
CAS: 105-85-1
Synonyms: Rhodinyl formate ; Citronellolformate ; Fema 2314 ; 6-octen-1-ol, 3,7-Dimethyl:formate ; 3,7-Dimethyl-6-octen-1-yl formate ; 2,6-Dimethyl-2-octen-8-yl formate ; 2,6-Imethyl-2-octen-8-ylformate ; 3,7-Dimethyl-6-octen-1-oformate
MF: C11H20O2
MW: 184.28
EINECS: 203-338-9
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Product Categories: Alphabetical Listings ; C-D ; Flavors and Fragrances
Mol File: 105-85-1.mol
FEMA 2314
Surface Tension: 28.3 dyne/cm
Density: 0.887 g/cm3
Flash Point: 95.3 °C
Enthalpy of Vaporization: 48.17 kJ/mol
Boiling Point: 244.7 °C at 760 mmHg
Vapour Pressure: 0.03 mmHg at 25°C
Uses
Citronellolformate (105-85-1) is used spices.
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | oral | 8400mg/kg (8400mg/kg) | Food and Cosmetics Toxicology. Vol. 11, Pg. 1073, 1973. |
Safety Profile
Hazard Codes: Xi .gif){kind=small}
Risk Statements: 36/37/38
36/37/38: Citronellolformate (105-85-1) is irritating to eyes, respiratory system and skin
Safety Statement:s 26-36/37/39
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37/39: Wear suitable protective clothing, gloves and eye/face protection
WGK Germany: 2
RTECS: RH3480000
Specification
Odor: Citronellolformate (105-85-1) has a light rosy note with a suggestion of citrus. A fresh, green, rose, fruity, pear note.
Human experience : 4 % solution: no irritation or sensitization Content: Citronellolformate contains not less than 86.0% of Citronellolformate.
Description: Citronellolformate is a colorless, transparent liquid having acharacteristic odor.
Identification :(1) To 1 ml of Citronellolformate, add 10 ml of ethanolic 10% potassium hydroxide TS, and heat in a water bath for 5 minutes while shaking. Thecharacteristic odor disappears, and an odor of citronellol is evolved.
(2) Proceed as directed in Identification .