Carbacyclin

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Names

[ Name ]:
Carbacyclin

[Synonym ]:
Carboprostacyclin
carbaprostacyclin
carbacyclin
Pentanoic acid, 5-[(3aS,4R,5R,6aS)-hexahydro-5-hydroxy-4-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2(1H)-pentalenylidene]-, (5Z)-
6a-Carba-pgi2
Carba pgx
6,9-Methano pgi2
6,9-Methanoprostaglandin I2
Carbacycline
(5Z)-5-[(3aS,4R,5R,6aS)-5-Hydroxy-4-[(1E,3S)-3-hydroxy-1-octen-1-yl]hexahydro-2(1H)-pentalenylidene]pentanoic acid
(5Z)-5-[(3aS,4R,5R,6aS)-5-hydroxy-4-[(1E,3S)-3-hydroxyoct-1-en-1-yl]hexahydropentalen-2(1H)-ylidene]pentanoic acid
MFCD00210824

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
514.8±50.0 °C at 760 mmHg

[ Melting Point ]:
65-67 °C

[ Molecular Formula ]:
C₂₁H₃₄O₄

[ Molecular Weight ]:
350.492

[ Flash Point ]:
279.2±26.6 °C

[ Exact Mass ]:
350.245697

[ PSA ]:
77.76000

[ LogP ]:
3.65

[ Vapour Pressure ]:
0.0±3.0 mmHg at 25°C

[ Index of Refraction ]:
1.611

MSDS

Click to get detail MSDS

Safety Information

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
22-36

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

(1R,2R,3aS,6aS,E)-1-((S,E)-3-hydroxyoct-1-en-1-yl)-5-(5-hydroxypentylidene)octahydropentalen-2-ol
(5E)-6a-carbaprostaglandin I2 bis(tetrahydropyranyl) ether
Carbaprostacyclin methyl ester
Phenylacetyl-triphenylsilan
(1S,2R,3aS,6aR,E)-5-(5-(benzyloxy)pentylidene)-1-((S,E)-3-hydroxyoct-1-en-1-yl)-6a-(phenylsulfonyl)octahydropentalen-2-ol
(((1R,4S)-4-((E)-7-(benzyloxy)-2-(chloromethyl)hept-2-en-1-yl)-3-(phenylsulfonyl)cyclopent-2-en-1-yl)oxy)(tert-butyl)diphenylsilane
(E)-7-(benzyloxy)-2-(((1S,4R)-4-((tert-butyldiphenylsilyl)oxy)-2-(phenylsulfonyl)cyclopent-2-en-1-yl)methyl)hept-2-en-1-ol
(((1R,4S)-4-((E)-7-(benzyloxy)-2-((methoxymethoxy)methyl)hept-2-en-1-yl)-3-(phenylsulfonyl)cyclopent-2-en-1-yl)oxy)(tert-butyl)diphenylsilane
(((1S,2R,3aS,6aR,E)-5-(5-(benzyloxy)pentylidene)-1-((S,E)-3-((tert-butyldimethylsilyl)oxy)oct-1-en-1-yl)-6a-(phenylsulfonyl)octahydropentalen-2-yl)oxy)(tert-butyl)diphenylsilane
(S)-tert-butyl-dimethyl(oct-1-en-3-yloxy)silane