[10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate

C93H63F109O18Si2 — CID 159668541

About [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate

[10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate (PubChem CID 159668541) has the molecular formula C93H63F109O18Si2 and a molecular weight of 3595.46 g/mol. Its IUPAC name is [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate.

Molecular Properties

• Compound Name: [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate
• PubChem CID: 159668541
• Molecular Formula: C93H63F109O18Si2
• Molecular Weight: 3595.46 g/mol
• Exact Mass: 3594.18
• IUPAC Name: [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate
• SMILES: C=C(C)C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CO[Si](CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C(=C)C)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C(=C)C.C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CO[Si](CC(C)C)(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C=C)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)CC
• InChI: InChI=1S/C50H31F61O9Si.C43H32F48O9Si/c1-15(2)18(112)115-9-22(53,54)29(67,68)36(81,82)42(93,94)45(99,100)39(87,88)32(73,74)25(59,60)12-118-121(8-7-21(51,52)28(65,66)35(79,80)48(105,106)49(107,108)50(109,110)111,119-13-26(61,62)33(75,76)40(89,90)46(101,102)43(95,96)37(83,84)30(69,70)23(55,56)10-116-19(113)16(3)4)120-14-27(63,64)34(77,78)41(91,92)47(103,104)44(97,98)38(85,86)31(71,72)24(57,58)11-117-20(114)17(5)6;1-6-17(92)95-10-20(44,45)26(56,57)32(68,69)38(80,81)41(86,87)35(74,75)29(62,63)23(50,51)13-98-101(9-16(4)5,99-14-24(52,53)30(64,65)36(76,77)42(88,89)39(82,83)33(70,71)27(58,59)21(46,47)11-96-18(93)7-2)100-15-25(54,55)31(66,67)37(78,79)43(90,91)40(84,85)34(72,73)28(60,61)22(48,49)12-97-19(94)8-3/h1,3,5,7-14H2,2,4,6H3;6-7,16H,1-2,8-15H2,3-5H3
• InChIKey: MTSMFXVSYBURKE-UHFFFAOYSA-N
• XLogP: 39.00
• TPSA: 213.18 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 87
• Heavy Atoms: 222
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3595.46
LogP ≤ 5	39.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate?

The IUPAC name of [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate (CID 159668541) is [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate.

What is the SMILES notation for [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate?

The canonical SMILES for [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate is C=C(C)C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CO[Si](CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C(=C)C)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C(=C)C.C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CO[Si](CC(C)C)(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)C=C)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)COC(=O)CC.

What is the InChIKey of [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate?

The InChIKey is MTSMFXVSYBURKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H31F61O9Si.C43H32F48O9Si/c1-15(2)18(112)115-9-22(53,54)29(67,68)36(81,82)42(93,94)45(99,100)39(87,88)32(73,74)25(59,60)12-118-121(8-7-21(51,52)28(65,66)35(79,80)48(105,106)49(107,108)50(109,110)111,119-13-26(61,62)33(75,76)40(89,90)46(101,102)43(95,96)37(83,84)30(69,70)23(55,56)10-116-19(113)16(3)4)120-14-27(63,64)34(77,78)41(91,92)47(103,104)44(97,98)38(85,86)31(71,72)24(57,58)11-117-20(114)17(5)6;1-6-17(92)95-10-20(44,45)26(56,57)32(68,69)38(80,81)41(86,87)35(74,75)29(62,63)23(50,51)13-98-101(9-16(4)5,99-14-24(52,53)30(64,65)36(76,77)42(88,89)39(82,83)33(70,71)27(58,59)21(46,47)11-96-18(93)7-2)100-15-25(54,55)31(66,67)37(78,79)43(90,91)40(84,85)34(72,73)28(60,61)22(48,49)12-97-19(94)8-3/h1,3,5,7-14H2,2,4,6H3;6-7,16H,1-2,8-15H2,3-5H3.

What are the key properties of [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate?

[10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate has a molecular weight of 3595.46 g/mol, XLogP of 39.00, 87 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for [10-[bis[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-methylprop-2-enoyloxy)decoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] 2-methylprop-2-enoate;[10-[bis(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-prop-2-enoyloxydecoxy)-(2-methylpropyl)silyl]oxy-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecyl] propanoate is sourced from PubChem (CID 159668541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).