dihexyl-methyl-phenylsilane

C19H34Si — CID 71342172

IUPACdihexyl-methyl-phenylsilane
SMILESCCCCCC[Si](C)(CCCCCC)c1ccccc1
InChIInChI=1S/C19H34Si/c1-4-6-8-13-17-20(3,18-14-9-7-5-2)19-15-11-10-12-16-19/h10-12,15-16H,4-9,13-14,17-18H2,1-3H3
InChIKeyXJCVPSCMOJMGNF-UHFFFAOYSA-N
MW290.57 g/mol
LogP6.13
Rot. Bonds11

About dihexyl-methyl-phenylsilane

dihexyl-methyl-phenylsilane (PubChem CID 71342172) has the molecular formula C19H34Si and a molecular weight of 290.57 g/mol. Its IUPAC name is dihexyl-methyl-phenylsilane.

Molecular Properties

Compound Namedihexyl-methyl-phenylsilane
PubChem CID71342172
Molecular FormulaC19H34Si
Molecular Weight290.57 g/mol
Exact Mass290.24
IUPAC Namedihexyl-methyl-phenylsilane
SMILESCCCCCC[Si](C)(CCCCCC)c1ccccc1
InChIInChI=1S/C19H34Si/c1-4-6-8-13-17-20(3,18-14-9-7-5-2)19-15-11-10-12-16-19/h10-12,15-16H,4-9,13-14,17-18H2,1-3H3
InChIKeyXJCVPSCMOJMGNF-UHFFFAOYSA-N
XLogP6.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.57
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

icosyl-dimethyl-phenylsilane
CID 91054385
decyl-methyl-diphenylsilane
CID 15259590
heptadecyl(triphenyl)silane
CID 4520075
[dihexyl(phenyl)silyl]-dihexyl-phenylsilane
CID 12059876
iodo-methyl-octyl-phenylsilane
CID 154486879
chloro-methyl-octyl-phenylsilane
CID 66989770
dichloro-heptyl-phenylsilane
CID 101161411
chloro-hexyl-iodo-phenylsilane
CID 154486835
[dimethyl(phenyl)silyl]-hexyl-methoxy-methylsilane
CID 139631934
1,1'-biphenyl;hexadecane
CID 173308514
dimethyl-(3-methylidenenonyl)-phenylsilane
CID 66553844
dimethyl-octyl-pyridin-3-ylsilane
CID 11196014

Frequently Asked Questions

What is the IUPAC name of dihexyl-methyl-phenylsilane?
The IUPAC name of dihexyl-methyl-phenylsilane (CID 71342172) is dihexyl-methyl-phenylsilane.
What is the SMILES notation for dihexyl-methyl-phenylsilane?
The canonical SMILES for dihexyl-methyl-phenylsilane is CCCCCC[Si](C)(CCCCCC)c1ccccc1.
What is the InChIKey of dihexyl-methyl-phenylsilane?
The InChIKey is XJCVPSCMOJMGNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34Si/c1-4-6-8-13-17-20(3,18-14-9-7-5-2)19-15-11-10-12-16-19/h10-12,15-16H,4-9,13-14,17-18H2,1-3H3.
What are the key properties of dihexyl-methyl-phenylsilane?
dihexyl-methyl-phenylsilane has a molecular weight of 290.57 g/mol, XLogP of 6.13, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dihexyl-methyl-phenylsilane is sourced from PubChem (CID 71342172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).