bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol

C51H119F6O17Si10+ — CID 158310381

IUPACbis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol
SMILESCC(O)COC(C)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[Si](C)(C)CCCOCC(C)OCC(C)O.C[SiH](C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[SiH](C)C.[H]/[C+]=C/COCC(C)OCC(C)O
InChIInChI=1S/C30H69F3O10Si5.C12H33F3O4Si5.C9H17O3/c1-26(34)22-38-28(3)24-36-17-14-19-44(5,6)40-46(9,10)42-48(13,21-16-30(31,32)33)43-47(11,12)41-45(7,8)20-15-18-37-25-29(4)39-23-27(2)35;1-20(2)16-22(5,6)18-24(9,11-10-12(13,14)15)19-23(7,8)17-21(3)4;1-4-5-11-7-9(3)12-6-8(2)10/h26-29,34-35H,14-25H2,1-13H3;20-21H,10-11H2,1-9H3;1,4,8-10H,5-7H2,2-3H3/q;;+1
InChIKeyGNPMUBCAQQDRJR-UHFFFAOYSA-N
MW1399.34 g/mol
LogP12.50
Rot. Bonds45

About bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol

bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol (PubChem CID 158310381) has the molecular formula C51H119F6O17Si10+ and a molecular weight of 1399.34 g/mol. Its IUPAC name is bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Namebis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol
PubChem CID158310381
Molecular FormulaC51H119F6O17Si10+
Molecular Weight1399.34 g/mol
Exact Mass1397.60
IUPAC Namebis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol
SMILESCC(O)COC(C)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[Si](C)(C)CCCOCC(C)OCC(C)O.C[SiH](C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[SiH](C)C.[H]/[C+]=C/COCC(C)OCC(C)O
InChIInChI=1S/C30H69F3O10Si5.C12H33F3O4Si5.C9H17O3/c1-26(34)22-38-28(3)24-36-17-14-19-44(5,6)40-46(9,10)42-48(13,21-16-30(31,32)33)43-47(11,12)41-45(7,8)20-15-18-37-25-29(4)39-23-27(2)35;1-20(2)16-22(5,6)18-24(9,11-10-12(13,14)15)19-23(7,8)17-21(3)4;1-4-5-11-7-9(3)12-6-8(2)10/h26-29,34-35H,14-25H2,1-13H3;20-21H,10-11H2,1-9H3;1,4,8-10H,5-7H2,2-3H3/q;;+1
InChIKeyGNPMUBCAQQDRJR-UHFFFAOYSA-N
XLogP12.50
TPSA189.91 Ų
H-Bond Donors3
H-Bond Acceptors17
Rotatable Bonds45
Heavy Atoms84
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001399.34
LogP ≤ 512.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol?
The IUPAC name of bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol (CID 158310381) is bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol.
What is the SMILES notation for bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol?
The canonical SMILES for bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol is CC(O)COC(C)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[Si](C)(C)CCCOCC(C)OCC(C)O.C[SiH](C)O[Si](C)(C)O[Si](C)(CCC(F)(F)F)O[Si](C)(C)O[SiH](C)C.[H]/[C+]=C/COCC(C)OCC(C)O.
What is the InChIKey of bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol?
The InChIKey is GNPMUBCAQQDRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H69F3O10Si5.C12H33F3O4Si5.C9H17O3/c1-26(34)22-38-28(3)24-36-17-14-19-44(5,6)40-46(9,10)42-48(13,21-16-30(31,32)33)43-47(11,12)41-45(7,8)20-15-18-37-25-29(4)39-23-27(2)35;1-20(2)16-22(5,6)18-24(9,11-10-12(13,14)15)19-23(7,8)17-21(3)4;1-4-5-11-7-9(3)12-6-8(2)10/h26-29,34-35H,14-25H2,1-13H3;20-21H,10-11H2,1-9H3;1,4,8-10H,5-7H2,2-3H3/q;;+1.
What are the key properties of bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol?
bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol has a molecular weight of 1399.34 g/mol, XLogP of 12.50, 45 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[dimethylsilyloxy(dimethyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane;1-[1-[3-[[[[[3-[2-(2-hydroxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-2-yloxy]propan-2-ol;1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol is sourced from PubChem (CID 158310381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).