dimethoxy(4,4,4-trifluorobutan-2-yl)silane

C6H13F3O2Si — CID 123462688

IUPACdimethoxy(4,4,4-trifluorobutan-2-yl)silane
SMILESCO[SiH](OC)C(C)CC(F)(F)F
InChIInChI=1S/C6H13F3O2Si/c1-5(4-6(7,8)9)12(10-2)11-3/h5,12H,4H2,1-3H3
InChIKeyQFBLJPHSQBCUNX-UHFFFAOYSA-N
MW202.25 g/mol
LogP1.84
Rot. Bonds4

About dimethoxy(4,4,4-trifluorobutan-2-yl)silane

dimethoxy(4,4,4-trifluorobutan-2-yl)silane (PubChem CID 123462688) has the molecular formula C6H13F3O2Si and a molecular weight of 202.25 g/mol. Its IUPAC name is dimethoxy(4,4,4-trifluorobutan-2-yl)silane.

Molecular Properties

Compound Namedimethoxy(4,4,4-trifluorobutan-2-yl)silane
PubChem CID123462688
Molecular FormulaC6H13F3O2Si
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC Namedimethoxy(4,4,4-trifluorobutan-2-yl)silane
SMILESCO[SiH](OC)C(C)CC(F)(F)F
InChIInChI=1S/C6H13F3O2Si/c1-5(4-6(7,8)9)12(10-2)11-3/h5,12H,4H2,1-3H3
InChIKeyQFBLJPHSQBCUNX-UHFFFAOYSA-N
XLogP1.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

di(propan-2-yloxy)-(4,4,4-trifluorobutan-2-yl)silane
CID 173041525
[6-dimethoxysilyl-4-(2-dimethoxysilylpropyl)-4-methylheptan-2-yl]-dimethoxysilane
CID 123257611
butan-2-yl(dimethoxy)silane;propane
CID 173302238
tris(2-dimethoxysilylpropyl)-methoxysilane
CID 154071556
1,1,1,3-tetrafluoro-3-methoxypropane
CID 141176664
dimethoxy(tridecan-2-yl)silane
CID 174991319
(3S)-1,1,1-trifluoro-3-iodobutane
CID 95036326
1,1,1,7,7,7-hexafluoro-3,5-dimethylheptane
CID 155426955
4-(3-dimethoxysilylbutyltrisulfanyl)butan-2-yl-dimethoxysilane
CID 154083059
3-ethyl-1,1,1-trifluoro-4-methylhexane
CID 147184105
tert-butyl-dimethoxy-(4,4,4-trifluorobutan-2-yl)silane
CID 22020734
dimethoxy(1,1,2,2,3,3,4,4,5,5,6,8,8,8-tetradecafluorooctyl)silane
CID 175373175

Frequently Asked Questions

What is the IUPAC name of dimethoxy(4,4,4-trifluorobutan-2-yl)silane?
The IUPAC name of dimethoxy(4,4,4-trifluorobutan-2-yl)silane (CID 123462688) is dimethoxy(4,4,4-trifluorobutan-2-yl)silane.
What is the SMILES notation for dimethoxy(4,4,4-trifluorobutan-2-yl)silane?
The canonical SMILES for dimethoxy(4,4,4-trifluorobutan-2-yl)silane is CO[SiH](OC)C(C)CC(F)(F)F.
What is the InChIKey of dimethoxy(4,4,4-trifluorobutan-2-yl)silane?
The InChIKey is QFBLJPHSQBCUNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F3O2Si/c1-5(4-6(7,8)9)12(10-2)11-3/h5,12H,4H2,1-3H3.
What are the key properties of dimethoxy(4,4,4-trifluorobutan-2-yl)silane?
dimethoxy(4,4,4-trifluorobutan-2-yl)silane has a molecular weight of 202.25 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy(4,4,4-trifluorobutan-2-yl)silane is sourced from PubChem (CID 123462688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).