methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane

C9H17F3OSi — CID 123561843

IUPACmethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
SMILESC[SiH2]C1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C9H17F3OSi/c1-14-8(4-2-3-7-13-8)5-6-9(10,11)12/h2-7,14H2,1H3
InChIKeyJDRBLKDDBYRQKO-UHFFFAOYSA-N
MW226.31 g/mol
LogP2.44
Rot. Bonds3

About methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane

methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane (PubChem CID 123561843) has the molecular formula C9H17F3OSi and a molecular weight of 226.31 g/mol. Its IUPAC name is methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane.

Molecular Properties

Compound Namemethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
PubChem CID123561843
Molecular FormulaC9H17F3OSi
Molecular Weight226.31 g/mol
Exact Mass226.10
IUPAC Namemethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
SMILESC[SiH2]C1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C9H17F3OSi/c1-14-8(4-2-3-7-13-8)5-6-9(10,11)12/h2-7,14H2,1H3
InChIKeyJDRBLKDDBYRQKO-UHFFFAOYSA-N
XLogP2.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.31
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4,4,4-Trifluorobutyl)oxan-2-yl]silane
CID 123561163
Dimethyl-propyl-[2-(trifluoromethyl)oxan-2-yl]silane
CID 69191346
Triethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 69483329
Trimethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 69887080
Ethenyl-dimethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 70260461
Trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 90185067
4-[2-[Methyl(3,3,3-trifluoropropyl)silyl]oxan-2-yl]butane-2-thiol
CID 123319629
[2-(2,2-Difluoropropyl)oxan-2-yl]silane
CID 123356426
Ethenyl-methyl-[2-(4,4,4-trifluorobutyl)oxan-2-yl]silane
CID 123486901
Dimethyl-[2-[[2-(3,3,3-trifluoropropylsilyl)oxan-2-yl]methyl]oxan-2-yl]silane
CID 123506086
(2-Methyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
CID 123611137
[2-(3,3,3-Trifluoropropyl)oxan-2-yl]silane
CID 123635641

Frequently Asked Questions

What is the IUPAC name of methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The IUPAC name of methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane (CID 123561843) is methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane.
What is the SMILES notation for methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The canonical SMILES for methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane is C[SiH2]C1(CCC(F)(F)F)CCCCO1.
What is the InChIKey of methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The InChIKey is JDRBLKDDBYRQKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3OSi/c1-14-8(4-2-3-7-13-8)5-6-9(10,11)12/h2-7,14H2,1H3.
What are the key properties of methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane has a molecular weight of 226.31 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane is sourced from PubChem (CID 123561843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).