6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene

C183H207F25O15S — CID 161059777

About 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene

6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene (PubChem CID 161059777) has the molecular formula C183H207F25O15S and a molecular weight of 3153.67 g/mol. Its IUPAC name is 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene.

Molecular Properties

• Compound Name: 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene
• PubChem CID: 161059777
• Molecular Formula: C183H207F25O15S
• Molecular Weight: 3153.67 g/mol
• Exact Mass: 3151.48
• IUPAC Name: 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene
• SMILES: C=CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(C=C)CC3)c(F)c1F)C2.C=CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(CCCCC)CC3)c(F)c1F)C2.CCCC1CC=C(COc2cc3c(c(F)c2F)Oc2c(ccc(OCC)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(CC(C)(F)F)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(CCCF)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(SCC)c2F)C3)CC1.CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(CCCF)CC3)c(F)c1F)C2
• InChI: InChI=1S/C29H35F3O2.C26H29F5O2.2C26H30F4O2.C26H27F3O2.C25H27F3O3.C25H29F3O2S/c1-3-5-7-8-19-10-12-20(13-11-19)18-33-24-17-23-16-22-15-14-21(9-6-4-2)25(30)28(22)34-29(23)27(32)26(24)31;1-3-4-15-5-7-16(8-6-15)14-32-20-12-19-11-17-9-10-18(13-26(2,30)31)21(27)24(17)33-25(19)23(29)22(20)28;1-2-4-18-10-11-19-13-20-14-21(23(29)24(30)26(20)32-25(19)22(18)28)31-15-17-8-6-16(7-9-17)5-3-12-27;1-2-4-16-6-8-17(9-7-16)15-31-21-14-20-13-19-11-10-18(5-3-12-27)22(28)25(19)32-26(20)24(30)23(21)29;1-3-5-6-18-11-12-19-13-20-14-21(30-15-17-9-7-16(4-2)8-10-17)23(28)24(29)26(20)31-25(19)22(18)27;1-3-5-15-6-8-16(9-7-15)14-30-20-13-18-12-17-10-11-19(29-4-2)22(27)24(17)31-25(18)23(28)21(20)26;1-3-5-15-6-8-16(9-7-15)14-29-19-13-18-12-17-10-11-20(31-4-2)22(27)24(17)30-25(18)23(28)21(19)26/h4,14-15,17,19-20H,2-3,5-13,16,18H2,1H3;9-10,12,15-16H,3-8,11,13-14H2,1-2H3;2*10-11,14,16-17H,2-9,12-13,15H2,1H3;3-4,11-12,14,16-17H,1-2,5-10,13,15H2;8,10-11,13,15H,3-7,9,12,14H2,1-2H3;10-11,13,15-16H,3-9,12,14H2,1-2H3
• InChIKey: UDGAPDZVVNJQBR-UHFFFAOYSA-N
• XLogP: 54.34
• TPSA: 138.45 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 54
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3153.67
LogP ≤ 5	54.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene?

The IUPAC name of 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene (CID 161059777) is 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene.

What is the SMILES notation for 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene?

The canonical SMILES for 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene is C=CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(C=C)CC3)c(F)c1F)C2.C=CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(CCCCC)CC3)c(F)c1F)C2.CCCC1CC=C(COc2cc3c(c(F)c2F)Oc2c(ccc(OCC)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(CC(C)(F)F)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(CCCF)c2F)C3)CC1.CCCC1CCC(COc2cc3c(c(F)c2F)Oc2c(ccc(SCC)c2F)C3)CC1.CCCc1ccc2c(c1F)Oc1c(cc(OCC3CCC(CCCF)CC3)c(F)c1F)C2.

What is the InChIKey of 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene?

The InChIKey is UDGAPDZVVNJQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H35F3O2.C26H29F5O2.2C26H30F4O2.C26H27F3O2.C25H27F3O3.C25H29F3O2S/c1-3-5-7-8-19-10-12-20(13-11-19)18-33-24-17-23-16-22-15-14-21(9-6-4-2)25(30)28(22)34-29(23)27(32)26(24)31;1-3-4-15-5-7-16(8-6-15)14-32-20-12-19-11-17-9-10-18(13-26(2,30)31)21(27)24(17)33-25(19)23(29)22(20)28;1-2-4-18-10-11-19-13-20-14-21(23(29)24(30)26(20)32-25(19)22(18)28)31-15-17-8-6-16(7-9-17)5-3-12-27;1-2-4-16-6-8-17(9-7-16)15-31-21-14-20-13-19-11-10-18(5-3-12-27)22(28)25(19)32-26(20)24(30)23(21)29;1-3-5-6-18-11-12-19-13-20-14-21(30-15-17-9-7-16(4-2)8-10-17)23(28)24(29)26(20)31-25(19)22(18)27;1-3-5-15-6-8-16(9-7-15)14-30-20-13-18-12-17-10-11-19(29-4-2)22(27)24(17)31-25(18)23(28)21(20)26;1-3-5-15-6-8-16(9-7-15)14-29-19-13-18-12-17-10-11-20(31-4-2)22(27)24(17)30-25(18)23(28)21(19)26/h4,14-15,17,19-20H,2-3,5-13,16,18H2,1H3;9-10,12,15-16H,3-8,11,13-14H2,1-2H3;2*10-11,14,16-17H,2-9,12-13,15H2,1H3;3-4,11-12,14,16-17H,1-2,5-10,13,15H2;8,10-11,13,15H,3-7,9,12,14H2,1-2H3;10-11,13,15-16H,3-9,12,14H2,1-2H3.

What are the key properties of 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene?

6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene has a molecular weight of 3153.67 g/mol, XLogP of 54.34, 54 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 6-but-3-enyl-2-[(4-ethenylcyclohexyl)methoxy]-3,4,5-trifluoro-9H-xanthene;6-but-3-enyl-3,4,5-trifluoro-2-[(4-pentylcyclohexyl)methoxy]-9H-xanthene;6-(2,2-difluoropropyl)-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;6-ethoxy-3,4,5-trifluoro-2-[(4-propylcyclohexen-1-yl)methoxy]-9H-xanthene;6-ethylsulfanyl-3,4,5-trifluoro-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene;3,4,5-trifluoro-2-[[4-(3-fluoropropyl)cyclohexyl]methoxy]-6-propyl-9H-xanthene;3,4,5-trifluoro-6-(3-fluoropropyl)-2-[(4-propylcyclohexyl)methoxy]-9H-xanthene is sourced from PubChem (CID 161059777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).