dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane

C22H26Si — CID 102040276

IUPACdimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane
SMILESC[Si](C)(CCCCc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H26Si/c1-23(2,21-15-4-3-5-16-21)18-9-8-12-20-14-10-13-19-11-6-7-17-22(19)20/h3-7,10-11,13-17H,8-9,12,18H2,1-2H3
InChIKeyNGBWJKDCOSSSDA-UHFFFAOYSA-N
MW318.54 g/mol
LogP5.78
Rot. Bonds6

About dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane

dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane (PubChem CID 102040276) has the molecular formula C22H26Si and a molecular weight of 318.54 g/mol. Its IUPAC name is dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane.

Molecular Properties

Compound Namedimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane
PubChem CID102040276
Molecular FormulaC22H26Si
Molecular Weight318.54 g/mol
Exact Mass318.18
IUPAC Namedimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane
SMILESC[Si](C)(CCCCc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H26Si/c1-23(2,21-15-4-3-5-16-21)18-9-8-12-20-14-10-13-19-11-6-7-17-22(19)20/h3-7,10-11,13-17H,8-9,12,18H2,1-2H3
InChIKeyNGBWJKDCOSSSDA-UHFFFAOYSA-N
XLogP5.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.54
LogP ≤ 55.78
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

chloro-(8-naphthalen-1-yloctyl)-diphenylsilane
CID 169088136
1-tetradecylnaphthalene
CID 14402128
tetrakis[dimethyl(3-naphthalen-1-ylpropyl)silyl] silicate
CID 58856778
1-butylnaphthalene;ethane
CID 142087052
1-(4-fluorobutyl)naphthalene
CID 174977280
1-(4-methoxybutyl)naphthalene
CID 69278949
potassium;hydride;1-octylnaphthalene
CID 173443599
8-naphthalen-1-yloctan-1-amine
CID 100987116
azane;1-butylnaphthalene;methane
CID 174691035
3-naphthalen-1-ylpropan-1-ol
CID 14711518
tributyl(2-naphthalen-1-ylethyl)silane
CID 140900135
N,N-dimethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059419

Frequently Asked Questions

What is the IUPAC name of dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane?
The IUPAC name of dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane (CID 102040276) is dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane.
What is the SMILES notation for dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane?
The canonical SMILES for dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane is C[Si](C)(CCCCc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane?
The InChIKey is NGBWJKDCOSSSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26Si/c1-23(2,21-15-4-3-5-16-21)18-9-8-12-20-14-10-13-19-11-6-7-17-22(19)20/h3-7,10-11,13-17H,8-9,12,18H2,1-2H3.
What are the key properties of dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane?
dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane has a molecular weight of 318.54 g/mol, XLogP of 5.78, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane is sourced from PubChem (CID 102040276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).