naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane

C36H32Si — CID 151935295

IUPACnaphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane
SMILESCCC(C[Si](c1ccccc1)(c1ccccc1)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C36H32Si/c1-2-28(33-25-13-17-29-15-9-11-23-34(29)33)27-37(31-19-5-3-6-20-31,32-21-7-4-8-22-32)36-26-14-18-30-16-10-12-24-35(30)36/h3-26,28H,2,27H2,1H3
InChIKeySZQWXRMNKJJRSC-UHFFFAOYSA-N
MW492.74 g/mol
LogP7.66
Rot. Bonds7

About naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane

naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane (PubChem CID 151935295) has the molecular formula C36H32Si and a molecular weight of 492.74 g/mol. Its IUPAC name is naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane.

Molecular Properties

Compound Namenaphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane
PubChem CID151935295
Molecular FormulaC36H32Si
Molecular Weight492.74 g/mol
Exact Mass492.23
IUPAC Namenaphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane
SMILESCCC(C[Si](c1ccccc1)(c1ccccc1)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C36H32Si/c1-2-28(33-25-13-17-29-15-9-11-23-34(29)33)27-37(31-19-5-3-6-20-31,32-21-7-4-8-22-32)36-26-14-18-30-16-10-12-24-35(30)36/h3-26,28H,2,27H2,1H3
InChIKeySZQWXRMNKJJRSC-UHFFFAOYSA-N
XLogP7.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.74
LogP ≤ 57.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-naphthalen-1-ylpropan-1-ol
CID 10877844
dichloro-ethyl-naphthalen-1-ylsilane
CID 90259567
1-[(2R)-butan-2-yl]naphthalene;pentane
CID 142150914
1-[1-(1-naphthalen-1-ylpropoxy)propyl]naphthalene
CID 57075140
methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane
CID 10990843
1-decan-5-ylnaphthalene
CID 14029915
1-tetracosan-9-ylnaphthalene
CID 175897855
1-hexadecan-6-ylnaphthalene
CID 14029925
butane;1-propan-2-ylnaphthalene
CID 157253186
(2S)-2-naphthalen-1-ylbutanenitrile
CID 132595059
1-(2-naphthalen-1-ylpentan-3-yl)naphthalene
CID 57238705
CID 175062668
CID 175062668

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane?
The IUPAC name of naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane (CID 151935295) is naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane.
What is the SMILES notation for naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane?
The canonical SMILES for naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane is CCC(C[Si](c1ccccc1)(c1ccccc1)c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane?
The InChIKey is SZQWXRMNKJJRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32Si/c1-2-28(33-25-13-17-29-15-9-11-23-34(29)33)27-37(31-19-5-3-6-20-31,32-21-7-4-8-22-32)36-26-14-18-30-16-10-12-24-35(30)36/h3-26,28H,2,27H2,1H3.
What are the key properties of naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane?
naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane has a molecular weight of 492.74 g/mol, XLogP of 7.66, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane is sourced from PubChem (CID 151935295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).