IUPAC Name: (2R,3S)-2-Decyl-3-(5-Methylhexyl)oxirane
Following is the structure of cis-7,8-Epoxy-2-methyloctadecane (CAS NO.29804-22-6):
Empirical Formula: C19H38O
Molecular Weight: 282.5044 g/mol
EINECS: 249-861-6
Density: 0.844 g/cm3
Flash Point: 139.7 °C
Index of Refraction: 1.448
Surface Tension: 30.7 dyne/cm
Enthalpy of Vaporization: 56.1 kJ/mol
Boiling Point: 340.6 °C at 760 mmHg
Vapour Pressure of cis-7,8-Epoxy-2-methyloctadecane (CAS NO.29804-22-6): 0.000168 mmHg at 25 °C
Canonical SMILES: CCCCCCCCCCC1C(O1)CCCCC(C)C
Isomeric SMILES: CCCCCCCCCC[C@@H]1[C@@H](O1)CCCCC(C)C
InChI: InChI=1S/C19H38O/c1-4-5-6-7-8-9-10-11-15-18-19(20-18)16-13-12-14-17(2)3/h17-19H,4-16H2,1-3H3/t18-,19+/m1/s1
InChIKey: HFOFYNMWYRXIBP-MOPGFXCFSA-N
1. | orl-rat LD50:>34,600 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 31 (1975),421. | ||
2. | ihl-rat LC50:>5000 mg/m3 | TXAPA9 Toxicology and Applied Pharmacology. 31 (1975),421. | ||
3. | skn-rbt LD50:>2025 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 31 (1975),421. |
Reported in EPA TSCA Inventory.
Moderately is toxic by skin contact. Low toxicity by ingestion. When heated to decomposition, cis-7,8-Epoxy-2-methyloctadecane (CAS NO.29804-22-6) emits acrid smoke and irritating vapors.
cis-7,8-Epoxy-2-methyloctadecane , its cas register number is 29804-22-6. It also can be called (+-)-Disparlure ; (+-)-cis-Disparlure ; (Z)-7,8-Epoxy-2-methyloctadecane ; Atralymon ; Disparlure ;Epoxan ; cis-2-Decyl-3-(5-methylhexyl)oxirane ; cis-7,8-Epoxy-2-methyloctadecane ; and Disparlure (2S-cis) . Its classification code are Agricultural Chemical; Insect attractant, repellent and chemosterilant; Insecticide and Pheromone.
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