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Home > Encyclopedia > (3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate)

(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate)

(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate) structure

(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate) 

structure
  • CAS No:

    39865-76-4

  • Formula:

    C30H34O6

  • Chemical Name:

    (3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate)

  • Synonyms:

    (3aR,4R,5R,6aS)-Hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate);SCHEMBL7743172;ZINC59840099;(1S,5R,6R,7R)-6-(3-oxo-(E)-1- decenyl)-7-(4-phenylbenzoyloxy)-2-oxabicyclo[3.3.0]octane-3-one;(1S,5R,6R,7R)-6-(3-oxo-(E)-1-decenyl)-7-(4-phenylbenzoyloxy)-2-oxabicyclo[3.3.0]octane-3-one;[(3aR,4R,5R,6aS)-2-oxo-4-[(E)-3-oxodec-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate

Description

Brown Oil

(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate) Basic Attributes

490.58736

474.240624 g/mol

Characteristics

69.7 Ų

6.31640

1.17±0.1 g/cm3(Predicted)

656.728ºC at 760 mmHg

277.82ºC

1.581

(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-(3-oxo-1-decenyl)-2H-cyclopenta[b]furan-2-one 5-(4-Phenylbenzoate) Use and Manufacturing

Intermediate in the preparation of prostaglandin derivatives

Computed Properties

Molecular Weight:474.6
XLogP3:6.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:12
Exact Mass:474.24062418
Monoisotopic Mass:474.24062418
Topological Polar Surface Area:69.7
Heavy Atom Count:35
Complexity:744
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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