About (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate
(3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate (PubChem CID 161373896) has the molecular formula C138H148F16O12
and a molecular weight of 2302.66 g/mol. Its IUPAC name is (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate.
Frequently Asked Questions
What is the IUPAC name of (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate?
The IUPAC name of (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate (CID 161373896) is (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate.
What is the SMILES notation for (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate?
The canonical SMILES for (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate is C.C.C.C.CC1(C)CCC=C1c1cc(COc2cccc([C@@H](CC(=O)O)C3CC3)c2)ccc1-c1cc(C(F)(F)F)ccc1F.CC1(C)CCC=C1c1cc(COc2cccc([C@H](CC(=O)O)C3CC3)c2)ccc1-c1cc(C(F)(F)F)ccc1F.COC(=O)C[C@@H](c1cccc(OCc2ccc(-c3cc(C(F)(F)F)ccc3F)c(C3=CCCC3(C)C)c2)c1)C1CC1.COC(=O)C[C@H](c1cccc(OCc2ccc(-c3cc(C(F)(F)F)ccc3F)c(C3=CCCC3(C)C)c2)c1)C1CC1.
What is the InChIKey of (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate?
The InChIKey is VQVCWLZZYPFIAM-LFSTXMKNSA-N. The full InChI is InChI=1S/2C34H34F4O3.2C33H32F4O3.4CH4/c2*1-33(2)15-5-8-30(33)28-16-21(9-13-26(28)29-18-24(34(36,37)38)12-14-31(29)35)20-41-25-7-4-6-23(17-25)27(22-10-11-22)19-32(39)40-3;2*1-32(2)14-4-7-29(32)27-15-20(8-12-25(27)28-17-23(33(35,36)37)11-13-30(28)34)19-40-24-6-3-5-22(16-24)26(18-31(38)39)21-9-10-21;;;;/h2*4,6-9,12-14,16-18,22,27H,5,10-11,15,19-20H2,1-3H3;2*3,5-8,11-13,15-17,21,26H,4,9-10,14,18-19H2,1-2H3,(H,38,39);4*1H4/t2*27-;2*26-;;;;/m1010..../s1.
What are the key properties of (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate?
(3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate has a molecular weight of 2302.66 g/mol, XLogP of 39.77, 36 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;(3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoic acid;methane;methyl (3S)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate;methyl (3R)-3-cyclopropyl-3-[3-[[3-(5,5-dimethylcyclopenten-1-yl)-4-[2-fluoro-5-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]propanoate is sourced from PubChem (CID 161373896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).