methyl (2Z,5Z)-7-[(2R)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hepta-2,5-dienoate
Names
[ CAS No. ]:
62559-74-4
[ Name ]:
methyl (2Z,5Z)-7-[(2R)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hepta-2,5-dienoate
[Synonym ]:
(Z)-7-hexadecenoic acid
Hypogeic acid
C16:1 (7-Z)
cis-7-Hexadecenoic Acid
cis-7-Hexadecensaeure
cis-Hexadecen-(7)-saeure-(1)
cis-Hexadecen-(7)-saeure
Chemical & Physical Properties
[ Density]:
1.298g/cm3
[ Boiling Point ]:
575.2ºC at 760 mmHg
[ Molecular Formula ]:
C24H29F3O6
[ Molecular Weight ]:
470.47900
[ Flash Point ]:
301.7ºC
[ Exact Mass ]:
470.19200
[ PSA ]:
96.22000
[ LogP ]:
3.42480
[ Index of Refraction ]:
1.567
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- MI5431500
- CHEMICAL NAME :
- 2,5-Heptadienoic acid, 7-(3,5-dihydroxy-2-(3-hydroxy-4-(3-(trifluoromethyl)p henoxy)-1- butenyl)cyclopentyl)-, methyl ester, (1R-(1-alpha(2E,5Z),2-beta(1E,3R*),3-alpha,5-alpha))-
- CAS REGISTRY NUMBER :
- 62559-74-4
- LAST UPDATED :
- 198910
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C24-H29-F3-O6
- MOLECULAR WEIGHT :
- 470.53
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 78 ug/kg
- SEX/DURATION :
- female 3-5 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 23,525,1980