5-Heptenoic acid,7-[(1R,2R,3R,5S)-2-[(1E)-3,3-difluoro-4-phenoxy-1-butenyl]-3,5-dihydroxycyclopentyl]-, 1-methylethyl ester, (5Z)-


Chemical Name: 5-Heptenoic acid,7-[(1R,2R,3R,5S)-2-[(1E)-3,3-difluoro-4-phenoxy-1-butenyl]-3,5-dihydroxycyclopentyl]-, 1-methylethyl ester, (5Z)-
CAS Number: 209860-87-7
Product Number: AG002KG9(AGN-PC-0QWXCT)
Synonyms:
MDL No: MFCD08062150
Molecular Formula: C25H34F2O5
Molecular Weight: 452.5313

Identification/Properties


Computed Properties
Molecular Weight:
452.539g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
13
Exact Mass:
452.237g/mol
Monoisotopic Mass:
452.237g/mol
Topological Polar Surface Area:
76A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
614
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback