dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane

C12H17F3OSi — CID 135086451

IUPACdimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane
SMILESCC(C)O[Si](C)(C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C12H17F3OSi/c1-9(2)16-17(3,4)11-7-5-10(6-8-11)12(13,14)15/h5-9H,1-4H3
InChIKeyMSXHEXQBJWCVKR-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.54
Rot. Bonds3

About dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane

dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane (PubChem CID 135086451) has the molecular formula C12H17F3OSi and a molecular weight of 262.35 g/mol. Its IUPAC name is dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane.

Molecular Properties

Compound Namedimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane
PubChem CID135086451
Molecular FormulaC12H17F3OSi
Molecular Weight262.35 g/mol
Exact Mass262.10
IUPAC Namedimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane
SMILESCC(C)O[Si](C)(C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C12H17F3OSi/c1-9(2)16-17(3,4)11-7-5-10(6-8-11)12(13,14)15/h5-9H,1-4H3
InChIKeyMSXHEXQBJWCVKR-UHFFFAOYSA-N
XLogP3.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]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

Triethoxy(p-tolyl)silane
CID 4670738
Benzyltriethoxysilane
CID 75690
Benzene, ((ethoxydimethylsilyl)methyl)-
CID 86972
Benzyl(methoxy)dimethylsilane
CID 12749810
Silane, trimethyl[4-(trifluoromethyl)phenyl]-
CID 10987739
Silane, methoxydimethyl(4-methylphenyl)-
CID 142850
Triethoxy(4-(trifluoromethyl)phenyl)silane
CID 11858742
trimethyl-[(E)-2-phenylprop-1-enoxy]silane
CID 6387112
Silane, triethyl[4-(trifluoromethyl)phenyl]-
CID 11065190
Phenethyltriethoxysilane
CID 11097560
Triethoxy(1-phenylethenyl)silane
CID 11196400
trimethyl-[(E)-1,1,1-trifluoro-2-methyl-4-phenylbut-3-en-2-yl]oxysilane
CID 24997841

Frequently Asked Questions

What is the IUPAC name of dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane?
The IUPAC name of dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane (CID 135086451) is dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane.
What is the SMILES notation for dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane?
The canonical SMILES for dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane is CC(C)O[Si](C)(C)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane?
The InChIKey is MSXHEXQBJWCVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17F3OSi/c1-9(2)16-17(3,4)11-7-5-10(6-8-11)12(13,14)15/h5-9H,1-4H3.
What are the key properties of dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane?
dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane has a molecular weight of 262.35 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-propan-2-yloxy-[4-(trifluoromethyl)phenyl]silane is sourced from PubChem (CID 135086451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).