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| CAS No.: | 65733-18-8 |
|---|---|
| Name: | S-HYDROPRENE |
| Article Data: | 6 |
| Molecular Structure: | |
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|
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| Formula: | C17H30O2 |
| Molecular Weight: | 266.4189 |
| Synonyms: | ethyl (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-dienoate;Zoecon RF-316;ZR 2006;Hydroprene (S)-form;EPA Pesticide Chemical Code 128966;2,4-Dodecadienoic acid,3,7,11-trimethyl-,ethyl ester,(2E,4E,7S)-;S-Hydroprene;Ethyl (2E,4E,7S)-trimethyl-2,4-dodecadienoate;2,4-Dodecadienoic acid, 3,7,11-trimethyl-, ethyl ester, (S-(E,E))-;(7S)-Hydroprene;ethyl (7S)-3,7,11-trimethyldodeca-2,4-dienoate; |
| Density: | 0.886 g/cm3 |
| Boiling Point: | 339.2 °C at 760 mmHg |
| Flash Point: | 153.8 °C |
| Hazard Symbols: |
 N
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| Risk Codes: | 50/53 |
| Safety: | 60-61 |
| Transport Information: | UN3082 9/PG 3 |
| PSA: | 26.30000 |
| LogP: | 4.90450 |
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Specification
The CAS registry number of S-Hydroprene (JAN) is 65733-18-8. The IUPAC name is ethyl (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-dienoate. In addition, the molecular formula is C17H30O2 and the molecular weight is 266.4189.
Physical properties about this S-Hydroprene (JAN) are: (1)ACD/LogP: 6.83; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.461; (8)Molar Refractivity: 82.45 cm3; (9)Molar Volume: 300.4 cm3; (10)Polarizability: 32.68 ×10-24cm3; (11)Surface Tension: 29.2 dyne/cm; (12)Density: 0.886 g/cm3; (13)Flash Point: 153.8 °C; (14)Enthalpy of Vaporization: 58.26 kJ/mol; (15)Boiling Point: 339.2 °C at 760 mmHg; (16)Vapour Pressure: 9.36E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. This material and/or its container must be disposed of as hazardous waste. During using it, avoid release to the environment. And it has refer to special instructions safety data sheet.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)\C=C(\C=C\CC(C)CCCC(C)C)C
(2)InChI: InChI=1/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8,12-15H,6-7,9-11H2,1-5H3/b12-8+,16-13+
(3)InChIKey: FYQGBXGJFWXIPP-UEVLXMDPBN