diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane

C20H30O2Si — CID 91742929

IUPACdiethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane
SMILESCC[Si](CC)(OCCCC(C)C)Oc1cccc2ccccc12
InChIInChI=1S/C20H30O2Si/c1-5-23(6-2,21-16-10-11-17(3)4)22-20-15-9-13-18-12-7-8-14-19(18)20/h7-9,12-15,17H,5-6,10-11,16H2,1-4H3
InChIKeySANXTYPGYRUGHE-UHFFFAOYSA-N
MW330.54 g/mol
LogP6.15
Rot. Bonds9

About diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane

diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane (PubChem CID 91742929) has the molecular formula C20H30O2Si and a molecular weight of 330.54 g/mol. Its IUPAC name is diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane.

Molecular Properties

Compound Namediethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane
PubChem CID91742929
Molecular FormulaC20H30O2Si
Molecular Weight330.54 g/mol
Exact Mass330.20
IUPAC Namediethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane
SMILESCC[Si](CC)(OCCCC(C)C)Oc1cccc2ccccc12
InChIInChI=1S/C20H30O2Si/c1-5-23(6-2,21-16-10-11-17(3)4)22-20-15-9-13-18-12-7-8-14-19(18)20/h7-9,12-15,17H,5-6,10-11,16H2,1-4H3
InChIKeySANXTYPGYRUGHE-UHFFFAOYSA-N
XLogP6.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.54
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

1-(4-methylpentoxy)naphthalene
CID 83168126
(2,6-dimethoxyphenoxy)-diethyl-tetradecoxysilane
CID 91745109
decoxy-diethyl-(2-phenylphenoxy)silane
CID 91736067
1-butoxynaphthalene
CID 13262700
diethyl-(4-methylpentoxy)-pentan-2-yloxysilane
CID 91738212
2-methyl-5-naphthalen-1-yloxypentanamide
CID 142457720
5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine
CID 63505261
decyl-dinaphthalen-1-yl-naphthalen-1-yloxysilane
CID 67918885
1-(3-chloropropoxy)naphthalene
CID 12685615
1-chloro-2-(4-methylpentoxy)benzene
CID 59060951
3-methyl-N-(2-naphthalen-1-yloxypropyl)butan-1-amine
CID 63506249
1,2-dimethyl-3-(4-methylpentoxy)benzene
CID 103432295

Frequently Asked Questions

What is the IUPAC name of diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane?
The IUPAC name of diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane (CID 91742929) is diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane.
What is the SMILES notation for diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane?
The canonical SMILES for diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane is CC[Si](CC)(OCCCC(C)C)Oc1cccc2ccccc12.
What is the InChIKey of diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane?
The InChIKey is SANXTYPGYRUGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30O2Si/c1-5-23(6-2,21-16-10-11-17(3)4)22-20-15-9-13-18-12-7-8-14-19(18)20/h7-9,12-15,17H,5-6,10-11,16H2,1-4H3.
What are the key properties of diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane?
diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane has a molecular weight of 330.54 g/mol, XLogP of 6.15, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(4-methylpentoxy)-naphthalen-1-yloxysilane is sourced from PubChem (CID 91742929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).