2,2-dimethylhexan-3-yloxy(diphenyl)silane

C20H28OSi — CID 173016744

IUPAC2,2-dimethylhexan-3-yloxy(diphenyl)silane
SMILESCCCC(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H28OSi/c1-5-12-19(20(2,3)4)21-22(17-13-8-6-9-14-17)18-15-10-7-11-16-18/h6-11,13-16,19,22H,5,12H2,1-4H3
InChIKeyHZFWNPRWXHXNIA-UHFFFAOYSA-N
MW312.53 g/mol
LogP3.76
Rot. Bonds6

About 2,2-dimethylhexan-3-yloxy(diphenyl)silane

2,2-dimethylhexan-3-yloxy(diphenyl)silane (PubChem CID 173016744) has the molecular formula C20H28OSi and a molecular weight of 312.53 g/mol. Its IUPAC name is 2,2-dimethylhexan-3-yloxy(diphenyl)silane.

Molecular Properties

Compound Name2,2-dimethylhexan-3-yloxy(diphenyl)silane
PubChem CID173016744
Molecular FormulaC20H28OSi
Molecular Weight312.53 g/mol
Exact Mass312.19
IUPAC Name2,2-dimethylhexan-3-yloxy(diphenyl)silane
SMILESCCCC(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H28OSi/c1-5-12-19(20(2,3)4)21-22(17-13-8-6-9-14-17)18-15-10-7-11-16-18/h6-11,13-16,19,22H,5,12H2,1-4H3
InChIKeyHZFWNPRWXHXNIA-UHFFFAOYSA-N
XLogP3.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.53
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-(2-diphenylsilyloxy-3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 173024422
2-(2,2-dimethylhexan-3-ylperoxy)propan-2-ylbenzene
CID 155094998
2-diphenylsilyloxy-3,3-dimethylbutanal
CID 173363396
[2,2-dimethyl-1-[(2R)-thiiran-2-yl]propoxy]-diphenylsilane
CID 154162263
(1-cyclobutyl-2,2-dimethylpropoxy)-diphenylsilane
CID 173387668
(4S)-3-diphenylsilyloxy-2,2,6-trimethylheptan-4-amine;trimethylalumane
CID 173186725
6-diphenylsilyloxy-7,7-dimethyloct-1-ene-4,5-diol
CID 173316919
(6-dimethylsilyloxy-7,7-dimethyloctyl)-triphenylphosphanium
CID 173329265
1-(2,2-dimethylhexan-3-yl)-4-phenoxybenzene;ethane
CID 145059782
[1-[1-(ethoxymethyl)imidazol-4-yl]-2,2-dimethylpropoxy]-diphenylsilane
CID 173491702
(2-phenyl-3-propylhexan-2-yl)benzene
CID 139749619
4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine
CID 173121594

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylhexan-3-yloxy(diphenyl)silane?
The IUPAC name of 2,2-dimethylhexan-3-yloxy(diphenyl)silane (CID 173016744) is 2,2-dimethylhexan-3-yloxy(diphenyl)silane.
What is the SMILES notation for 2,2-dimethylhexan-3-yloxy(diphenyl)silane?
The canonical SMILES for 2,2-dimethylhexan-3-yloxy(diphenyl)silane is CCCC(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C.
What is the InChIKey of 2,2-dimethylhexan-3-yloxy(diphenyl)silane?
The InChIKey is HZFWNPRWXHXNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28OSi/c1-5-12-19(20(2,3)4)21-22(17-13-8-6-9-14-17)18-15-10-7-11-16-18/h6-11,13-16,19,22H,5,12H2,1-4H3.
What are the key properties of 2,2-dimethylhexan-3-yloxy(diphenyl)silane?
2,2-dimethylhexan-3-yloxy(diphenyl)silane has a molecular weight of 312.53 g/mol, XLogP of 3.76, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylhexan-3-yloxy(diphenyl)silane is sourced from PubChem (CID 173016744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).