2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane

C130H175F45O24 — CID 157281693

IUPAC2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane
SMILESC.C.C=C(C)c1c(C(C)(C)OCC(C)(O)C(F)(F)F)c(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cc(C(C)(C)OCC(C)(C)O)cc12.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cccc12
InChIInChI=1S/C37H48F18O8.C34H48F6O6.C30H37F15O6.C27H34F6O4.2CH4/c1-18(2)21-22(26(7,8)60-14-28(11,56)32(38,39)40)19(24(3,4)62-16-30(58,34(44,45)46)35(47,48)49)13-20(23(21)27(9,10)61-15-29(12,57)33(41,42)43)25(5,6)63-17-31(59,36(50,51)52)37(53,54)55;1-20(2)23-13-21(29(7,8)46-19-32(43,33(35,36)37)34(38,39)40)15-25-24(23)14-22(30(9,10)44-17-27(3,4)41)16-26(25)31(11,12)45-18-28(5,6)42;1-15(2)17-10-16(20(3,4)50-13-24(47,27(34,35)36)28(37,38)39)11-18(19(17)22(7,8)49-12-23(9,46)26(31,32)33)21(5,6)51-14-25(48,29(40,41)42)30(43,44)45;1-16(2)19-12-17(23(5,6)37-15-25(35,26(28,29)30)27(31,32)33)13-20-18(19)10-9-11-21(20)24(7,8)36-14-22(3,4)34;;/h13,56-59H,1,14-17H2,2-12H3;13-16,41-43H,1,17-19H2,2-12H3;10-11,46-48H,1,12-14H2,2-9H3;9-13,34-35H,1,14-15H2,2-8H3;2*1H4
InChIKeyAZSVOHQRIYDMST-UHFFFAOYSA-N
MW2976.72 g/mol
LogP34.86
Rot. Bonds52

About 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane

2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane (PubChem CID 157281693) has the molecular formula C130H175F45O24 and a molecular weight of 2976.72 g/mol. Its IUPAC name is 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane.

Molecular Properties

Compound Name2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane
PubChem CID157281693
Molecular FormulaC130H175F45O24
Molecular Weight2976.72 g/mol
Exact Mass2975.18
IUPAC Name2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane
SMILESC.C.C=C(C)c1c(C(C)(C)OCC(C)(O)C(F)(F)F)c(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cc(C(C)(C)OCC(C)(C)O)cc12.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cccc12
InChIInChI=1S/C37H48F18O8.C34H48F6O6.C30H37F15O6.C27H34F6O4.2CH4/c1-18(2)21-22(26(7,8)60-14-28(11,56)32(38,39)40)19(24(3,4)62-16-30(58,34(44,45)46)35(47,48)49)13-20(23(21)27(9,10)61-15-29(12,57)33(41,42)43)25(5,6)63-17-31(59,36(50,51)52)37(53,54)55;1-20(2)23-13-21(29(7,8)46-19-32(43,33(35,36)37)34(38,39)40)15-25-24(23)14-22(30(9,10)44-17-27(3,4)41)16-26(25)31(11,12)45-18-28(5,6)42;1-15(2)17-10-16(20(3,4)50-13-24(47,27(34,35)36)28(37,38)39)11-18(19(17)22(7,8)49-12-23(9,46)26(31,32)33)21(5,6)51-14-25(48,29(40,41)42)30(43,44)45;1-16(2)19-12-17(23(5,6)37-15-25(35,26(28,29)30)27(31,32)33)13-20-18(19)10-9-11-21(20)24(7,8)36-14-22(3,4)34;;/h13,56-59H,1,14-17H2,2-12H3;13-16,41-43H,1,17-19H2,2-12H3;10-11,46-48H,1,12-14H2,2-9H3;9-13,34-35H,1,14-15H2,2-8H3;2*1H4
InChIKeyAZSVOHQRIYDMST-UHFFFAOYSA-N
XLogP34.86
TPSA353.52 Ų
H-Bond Donors12
H-Bond Acceptors24
Rotatable Bonds52
Heavy Atoms199
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002976.72
LogP ≤ 534.86
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1024

Analyze 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane with MolForge

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Related Compounds

(2S,3S,4R,5R,6R)-4,5-bis(naphthalen-2-ylmethoxy)-6-(naphthalen-2-ylmethoxymethyl)-2-propyloxan-3-ol
CID 44440798
[(2S,3S,4S,5R,6R)-4,5-bis(naphthalen-2-ylmethoxy)-6-(naphthalen-2-ylmethoxymethyl)-2-propyloxan-3-yl] acetate
CID 44440799
1,1,1-Trifluoro-3,4,5-tris(phenylmethoxy)-6-trityloxyhexan-2-ol
CID 134833761
CID 134950203
CID 134950203
(2R,3R,6R)-4,4,5,5-tetrafluoro-6-(hydroxymethyl)-2-(naphthalen-2-ylmethoxy)oxan-3-ol
CID 168330166
4-Ethyl-1-[[[4-ethyl-2-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)phenyl]-diphenylmethoxy]-diphenylmethyl]-2-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)benzene
CID 57301043
4-Ethyl-1-[[[4-ethyl-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)phenyl]-diphenylmethoxy]-diphenylmethyl]-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)benzene
CID 57305746
(2R,3R,4S,5R,6R)-2-[difluoro-[2-[(4-methylphenyl)methyl]phenyl]methyl]-6-ethyl-5-methyl-3,4-bis(phenylmethoxy)oxan-2-ol
CID 58133510
1-(2-Anthracen-2-yl-1,1,1,3,3,3-hexafluoropropan-2-yl)oxybutan-2-ol
CID 58952854
(3R,4S,5R,6R)-2-[4-fluoro-2,5-bis(2-methoxypropan-2-yloxymethyl)phenyl]-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-ol
CID 59488831
(20S,21S)-19-fluoro-20,21-bis(phenylmethoxy)-2,15,18-trioxatetracyclo[15.3.1.04,13.06,11]henicosa-4,6,8,10,12-pentaene
CID 59628268
(2S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-(trityloxymethyl)pent-4-en-1-ol
CID 87972728

Frequently Asked Questions

What is the IUPAC name of 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane?
The IUPAC name of 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane (CID 157281693) is 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane.
What is the SMILES notation for 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane?
The canonical SMILES for 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane is C.C.C=C(C)c1c(C(C)(C)OCC(C)(O)C(F)(F)F)c(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)c1C(C)(C)OCC(C)(O)C(F)(F)F.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cc(C(C)(C)OCC(C)(C)O)cc12.C=C(C)c1cc(C(C)(C)OCC(O)(C(F)(F)F)C(F)(F)F)cc2c(C(C)(C)OCC(C)(C)O)cccc12.
What is the InChIKey of 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane?
The InChIKey is AZSVOHQRIYDMST-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H48F18O8.C34H48F6O6.C30H37F15O6.C27H34F6O4.2CH4/c1-18(2)21-22(26(7,8)60-14-28(11,56)32(38,39)40)19(24(3,4)62-16-30(58,34(44,45)46)35(47,48)49)13-20(23(21)27(9,10)61-15-29(12,57)33(41,42)43)25(5,6)63-17-31(59,36(50,51)52)37(53,54)55;1-20(2)23-13-21(29(7,8)46-19-32(43,33(35,36)37)34(38,39)40)15-25-24(23)14-22(30(9,10)44-17-27(3,4)41)16-26(25)31(11,12)45-18-28(5,6)42;1-15(2)17-10-16(20(3,4)50-13-24(47,27(34,35)36)28(37,38)39)11-18(19(17)22(7,8)49-12-23(9,46)26(31,32)33)21(5,6)51-14-25(48,29(40,41)42)30(43,44)45;1-16(2)19-12-17(23(5,6)37-15-25(35,26(28,29)30)27(31,32)33)13-20-18(19)10-9-11-21(20)24(7,8)36-14-22(3,4)34;;/h13,56-59H,1,14-17H2,2-12H3;13-16,41-43H,1,17-19H2,2-12H3;10-11,46-48H,1,12-14H2,2-9H3;9-13,34-35H,1,14-15H2,2-8H3;2*1H4.
What are the key properties of 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane?
2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane has a molecular weight of 2976.72 g/mol, XLogP of 34.86, 52 rotatable bonds, 12 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[6,8-bis[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[8-[2-(2-hydroxy-2-methylpropoxy)propan-2-yl]-4-prop-1-en-2-ylnaphthalen-2-yl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-2,4-bis[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[2-[3-prop-1-en-2-yl-4-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)propan-2-yl]-5-[2-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy]propan-2-yl]phenyl]propan-2-yloxymethyl]propan-2-ol;methane is sourced from PubChem (CID 157281693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).