(E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid

Modify Date: 2025-09-20 10:48:39

(E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid Structure
(E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid structure
 Common Name (E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid
CAS Number 81443-73-4 Molecular Weight 477.59200
Density 1.21g/cm3 Boiling Point 657.5ºC at 760 mmHg
Molecular Formula C29H35NO5 Melting Point N/A
MSDS N/A Flash Point 351.4ºC

 Names

Name (E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid

 Chemical & Physical Properties

Density 1.21g/cm3
Boiling Point 657.5ºC at 760 mmHg
Molecular Formula C29H35NO5
Molecular Weight 477.59200
Flash Point 351.4ºC
Exact Mass 477.25200
PSA 76.07000
LogP 4.66770
Index of Refraction 1.603
InChIKey IOFUFYLETVNNRF-UHFFFAOYSA-N
SMILES O=C(O)CCC=CCCC1C(OCc2ccc(-c3ccccc3)cc2)CC(=O)C1N1CCOCC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MJ9651150
CHEMICAL NAME :
4-Heptenoic acid, 7-(5-((1,1'-biphenyl)-4-ylmethoxy)-2-(4-morpholinyl)- 3-oxocyclopentyl)-, (1-alpha(Z),2-beta,5-alpha)-(+-)-
CAS REGISTRY NUMBER :
81443-73-4
LAST UPDATED :
199706
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C29-H35-N-O5
MOLECULAR WEIGHT :
477.65

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
750 mg/kg
SEX/DURATION :
female 12-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - body wall
REFERENCE :
ParMM# Personal Communication from M.M. Parkinson, Glaxo Group Research Limited, Ware, Hertfordshire, SG12 0DJ, UK, Mar. 24, 1987 Volume(issue)/page/year: 24MAR1987
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
1500 mg/kg
SEX/DURATION :
female 12-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
REFERENCE :
TJADAB Teratology, The International Journal of Abnormal Development. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1968- Volume(issue)/page/year: 39,537,1989
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Chemsrc provides CAS#:81443-73-4 MSDS, density, melting point, boiling point, structure, etc. Its name is (E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid>> amp version: (E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enoic acid

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