hexyl-methyl-phenylsilane

C13H22Si — CID 14945725

IUPAChexyl-methyl-phenylsilane
SMILESCCCCCC[SiH](C)c1ccccc1
InChIInChI=1S/C13H22Si/c1-3-4-5-9-12-14(2)13-10-7-6-8-11-13/h6-8,10-11,14H,3-5,9,12H2,1-2H3
InChIKeyYKZPZJMFVOQAQL-UHFFFAOYSA-N
MW206.41 g/mol
LogP3.33
Rot. Bonds6

About hexyl-methyl-phenylsilane

hexyl-methyl-phenylsilane (PubChem CID 14945725) has the molecular formula C13H22Si and a molecular weight of 206.41 g/mol. Its IUPAC name is hexyl-methyl-phenylsilane.

Molecular Properties

Compound Namehexyl-methyl-phenylsilane
PubChem CID14945725
Molecular FormulaC13H22Si
Molecular Weight206.41 g/mol
Exact Mass206.15
IUPAC Namehexyl-methyl-phenylsilane
SMILESCCCCCC[SiH](C)c1ccccc1
InChIInChI=1S/C13H22Si/c1-3-4-5-9-12-14(2)13-10-7-6-8-11-13/h6-8,10-11,14H,3-5,9,12H2,1-2H3
InChIKeyYKZPZJMFVOQAQL-UHFFFAOYSA-N
XLogP3.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.41
LogP ≤ 53.33
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

hexyl(diphenyl)silane
CID 15142320
3-[methyl(phenyl)silyl]propan-1-amine
CID 172834952
4-[methyl(phenyl)silyl]butanenitrile
CID 123718156
decyl-non-1-enyl-phenylsilane
CID 154074646
methyl-phenyl-(2-phenylethyl)silane
CID 4205542
1,1'-biphenyl;hexadecane
CID 173308514
dihexadecoxy(phenyl)silane
CID 173048581
benzene;heptane;hexane;toluene
CID 160959480
bis(heptane);toluene
CID 157306102
ethane;heptane;toluene
CID 145106448
decane;sulfane;toluene
CID 157105742
hexakis(decane);ethylbenzene
CID 173398562

Frequently Asked Questions

What is the IUPAC name of hexyl-methyl-phenylsilane?
The IUPAC name of hexyl-methyl-phenylsilane (CID 14945725) is hexyl-methyl-phenylsilane.
What is the SMILES notation for hexyl-methyl-phenylsilane?
The canonical SMILES for hexyl-methyl-phenylsilane is CCCCCC[SiH](C)c1ccccc1.
What is the InChIKey of hexyl-methyl-phenylsilane?
The InChIKey is YKZPZJMFVOQAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22Si/c1-3-4-5-9-12-14(2)13-10-7-6-8-11-13/h6-8,10-11,14H,3-5,9,12H2,1-2H3.
What are the key properties of hexyl-methyl-phenylsilane?
hexyl-methyl-phenylsilane has a molecular weight of 206.41 g/mol, XLogP of 3.33, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl-methyl-phenylsilane is sourced from PubChem (CID 14945725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).