Molecular Formula | C12H20O2 |
Molar Mass | 196.29 |
Density | 0.91g/mLat 25°C(lit.) |
Boling Point | 134°C25mm Hg(lit.) |
Specific Rotation(α) | n20/D 1.460 (lit.) |
Flash Point | 210°F |
JECFA Number | 59 |
Water Solubility | 34.51-773.28mg/L at 20℃ |
Solubility | Slightly soluble in water, soluble in ethanol, ether, common organic solvents and essential oils. |
Vapor Presure | 2.39-3.63Pa at 20℃ |
Appearance | Colorless to slightly yellow transparent liquid |
Color | Colorless to Light yellow to Light orange |
BRN | 1722814 |
Storage Condition | 2-8°C |
Refractive Index | n20/D 1.460(lit.) |
MDL | MFCD00063205 |
Physical and Chemical Properties | Colorless to yellowish oily liquid with orange flower and rose aroma and honey and raspberry sweet aroma. The boiling point is 231 ° C. Or 134 ° C. (3333Pa), the optical rotation of the natural product is 11 ° to 14 °, and the synthetic product is ± 0 °. Soluble in ethanol, various essential oils and most common organic solvents. Natural products are found in essential oils such as lemon, orange flower, and bitter orange leaf. |
Hazard Symbols | Xi - Irritant |
Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S23 - Do not breathe vapour. S24/25 - Avoid contact with skin and eyes. S37/39 - Wear suitable gloves and eye/face protection S36 - Wear suitable protective clothing. S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
WGK Germany | 2 |
RTECS | RG5921000 |
FLUKA BRAND F CODES | 9-23 |
TSCA | Yes |
HS Code | 29153900 |
Toxicity | Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Levenstein, 1972). |
FEMA | 2773 | NERYL ACETATE |
LogP | 2.76-3.98 at 30-37℃ |
EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
content analysis | determined by ester determination in OT-18. The sample quantity is 1g, and the equivalent factor (e) in the calculation is 98.15. Among them, the content of cis isomer is the main one, which is determined by polar column method in gas chromatography in GT-10-4. |
toxicity | GRAS(FEMA). |
usage limit | FEMA(mg/kg): soft drink 1.3; Cold drink 1.6; Candy 5.1; Baked goods 15. Moderate limit (FDA § 172.515,2000). |
use | GB 2760-1996 specified as allowed edible spices. It is mainly used to prepare fruit flavors such as raw pears, apples, lemons, peaches, raspberries, and citrus. |
production method | is esterified by nerol and acetic acid. |