Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate

Basic Information

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CAS Number

130209-76-6

Molecular Formula

C26H38O5

Molecular Weight

430.59 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC(C)OC(=O)CCCC=CCC1C(CC(C1C=CC(CCC2=CC=CC=C2)O)O)O

InChI

InChI=1S/C26H38O5/c1-19(2)31-26(30)13-9-4-3-8-12-22-23(25(29)18-24(22)28)17-16-21(27)15-14-20-10-6-5-7-11-20/h3,5-8,10-11,16-17,19,21-25,27-29H,4,9,12-15,18H2,1-2H3/b8-3-,17-16+/t21-,22+,23+,24-,25+/m0/s1

InChIKey

JGZRPRSJSQLFBO-FWPUOYPASA-N

LogP

3.9624000000000055

Topological Polar Surface Area

86.99000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

564

Synonyms & References

English

UNII-1IFH52MD8T
PhDH 100A
isopropyl 9S,11R,15S-trihydroxy-17-phenyl-18,19,20-trinor-5Z,13E-prostadienoate
Q27252458
HMS3648J18
dehydrolatanoprost
Phdh100A
DEHYDROLATANOPROST [INCI]
17-phenyl trinor Prostaglandin F2?? isopropyl ester
130209-76-6
5-HEPTENOIC ACID, 7-((1R,2R,3R,5S)-3,5-DIHYDROXY-2-((1E,3S)-3-HYDROXY-5-PHENYL-1-PENTENYL)CYCLOPENTYL)-, 1-METHYLETHYL ESTER, (5Z)-
SR-01000946519
CHEBI:137717
JGZRPRSJSQLFBO-FWPUOYPASA-N
17-PHENYL-18,19,20-TRINOR-PGF2.ALPHA.-1-ISOPROPYL ESTER
CAS_130209-76-6
17-phenyl-trinor-PGF2alpha isopropyl ester
17-Phenyl-18,19,20-trinor-pgf2alpha-1-isopropyl ester
CHEMBL2111623
17-phenyl trinor PGF2(c) paragraph sign-iPr;17-phenyl trinor PGF2(c) paragraph sign isopropyl ester
SR-01000946519-1
(1R-(1alpha(Z),2beta(1E,3S*),3alpha,5alpha))-1-Methylethyl 7-(3,5-dihydroxy-2-(3-hydroxy-5-phenyl-1-pentenyl)cyclopentyl)-5-heptenoate
Isopropyl (Z)-7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((3S,E)-3-hydroxy-5-phenyl-pent-1-enyl)-cyclopentyl)-hept-5-enoate
1IFH52MD8T
propan-2-yl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]hept-5-enoate
LMFA03010124
17-phenyl-trinor-Prostaglandin F2alpha isopropyl ester
130273-87-9
17-Phenyl trinor Pgf2alpha-Ipr
AKOS040756131
BCP29022

MDL Number

MFCD00902150

FAQ

What are the physical and chemical properties of Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6)?

Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6) is a crystalline compound with a molecular weight of approximately 442.48 g/mol. It has a low solubility in water but is soluble in organic solvents like ethanol and acetone. Chemically, it is relatively stable but can react with strong bases and acids. It is typically used in research and pharmaceutical applications due to its unique structural features.

How is Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6) typically synthesized?

Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6) is synthesized through a multi-step process involving the synthesis of the cyclopentenone intermediate, followed by condensation with an isopropyl derivative. The reaction is typically catalyzed by palladium complexes and proceeds with high selectivity and yield. Detailed synthetic procedures are available in the literature.

What industries use Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6)?

Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6) is primarily used in the pharmaceutical industry for the development of novel drug candidates. It is also explored in organic synthesis, particularly for the construction of complex molecules. Additionally, it may have potential applications in the synthesis of new materials and sensors.

What precautions should be taken when handling Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6)?

When handling Isopropyl (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-5-heptenoate (CAS: 130209-76-6), use appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Store it in a cool, dry place away from direct sunlight and heat sources. Handle in a well-ventilated area or fume hood to minimize inhalation risks. In case of a spill, follow standard safety protocols and consult the material safety data sheet (MSDS) for specific instructions.