bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane

C9H14F12O3Si2 — CID 173190735

IUPACbis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane
SMILESC=CC[SiH2]O[SiH3].OC(C(F)(F)F)C(F)(F)F.OC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/2C3H2F6O.C3H10OSi2/c2*4-2(5,6)1(10)3(7,8)9;1-2-3-6-4-5/h2*1,10H;2H,1,3,6H2,5H3
InChIKeyVBZMPFLAUIJSPR-UHFFFAOYSA-N
MW454.36 g/mol
LogP1.92
Rot. Bonds3

About bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane

bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane (PubChem CID 173190735) has the molecular formula C9H14F12O3Si2 and a molecular weight of 454.36 g/mol. Its IUPAC name is bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane.

Molecular Properties

Compound Namebis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane
PubChem CID173190735
Molecular FormulaC9H14F12O3Si2
Molecular Weight454.36 g/mol
Exact Mass454.03
IUPAC Namebis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane
SMILESC=CC[SiH2]O[SiH3].OC(C(F)(F)F)C(F)(F)F.OC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/2C3H2F6O.C3H10OSi2/c2*4-2(5,6)1(10)3(7,8)9;1-2-3-6-4-5/h2*1,10H;2H,1,3,6H2,5H3
InChIKeyVBZMPFLAUIJSPR-UHFFFAOYSA-N
XLogP1.92
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.36
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,2,3,3,3-heptafluoropropan-2-yloxy(prop-2-enyl)silane
CID 173431588
non-8-enyl(silyloxy)silane
CID 173408450
silyloxy(1,1,1-trifluorohex-5-en-3-yl)silane
CID 173346968
1,1,1-trifluorooct-7-en-2-ol
CID 54303988
bis(1,1,1,3,3,3-hexafluoropropan-2-ol);styrene
CID 22506486
prop-2-enyl-[5-(5-prop-2-enylsilylocta-1,4,7-trien-4-yloxy)octa-1,4,7-trien-4-yl]silane
CID 173423265
(4R)-5,5,5-trifluoro-4-methylpent-1-ene
CID 89023731
1-silyloxysilylprop-2-en-1-ol
CID 173215353
(1R)-2,2,2-trifluoro-1-(4-prop-2-enoxyphenyl)ethanol
CID 71494810
silyloxy(3,3,3-trifluoropropyl)silane
CID 123322997
bis(1,1,1,3,3,3-hexafluoropropan-2-ol);sulfurous acid
CID 71441894
1,1,1,3,3,3-hexafluoropropan-2-ol;sulfuric acid
CID 146471813

Frequently Asked Questions

What is the IUPAC name of bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane?
The IUPAC name of bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane (CID 173190735) is bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane.
What is the SMILES notation for bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane?
The canonical SMILES for bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane is C=CC[SiH2]O[SiH3].OC(C(F)(F)F)C(F)(F)F.OC(C(F)(F)F)C(F)(F)F.
What is the InChIKey of bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane?
The InChIKey is VBZMPFLAUIJSPR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H2F6O.C3H10OSi2/c2*4-2(5,6)1(10)3(7,8)9;1-2-3-6-4-5/h2*1,10H;2H,1,3,6H2,5H3.
What are the key properties of bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane?
bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane has a molecular weight of 454.36 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,1,1,3,3,3-hexafluoropropan-2-ol);prop-2-enyl(silyloxy)silane is sourced from PubChem (CID 173190735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).