(3-methoxynaphthalen-2-yl)-triphenylsilane

C29H24OSi — CID 4229060

IUPAC(3-methoxynaphthalen-2-yl)-triphenylsilane
SMILESCOc1cc2ccccc2cc1[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C29H24OSi/c1-30-28-21-23-13-11-12-14-24(23)22-29(28)31(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-22H,1H3
InChIKeyIVHYVSVYOGOELZ-UHFFFAOYSA-N
MW416.60 g/mol
LogP4.23
Rot. Bonds5

About (3-methoxynaphthalen-2-yl)-triphenylsilane

(3-methoxynaphthalen-2-yl)-triphenylsilane (PubChem CID 4229060) has the molecular formula C29H24OSi and a molecular weight of 416.60 g/mol. Its IUPAC name is (3-methoxynaphthalen-2-yl)-triphenylsilane.

Molecular Properties

Compound Name(3-methoxynaphthalen-2-yl)-triphenylsilane
PubChem CID4229060
Molecular FormulaC29H24OSi
Molecular Weight416.60 g/mol
Exact Mass416.16
IUPAC Name(3-methoxynaphthalen-2-yl)-triphenylsilane
SMILESCOc1cc2ccccc2cc1[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C29H24OSi/c1-30-28-21-23-13-11-12-14-24(23)22-29(28)31(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-22H,1H3
InChIKeyIVHYVSVYOGOELZ-UHFFFAOYSA-N
XLogP4.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.60
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-methoxynaphthalen-2-yl)-triphenylsilane?
The IUPAC name of (3-methoxynaphthalen-2-yl)-triphenylsilane (CID 4229060) is (3-methoxynaphthalen-2-yl)-triphenylsilane.
What is the SMILES notation for (3-methoxynaphthalen-2-yl)-triphenylsilane?
The canonical SMILES for (3-methoxynaphthalen-2-yl)-triphenylsilane is COc1cc2ccccc2cc1[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (3-methoxynaphthalen-2-yl)-triphenylsilane?
The InChIKey is IVHYVSVYOGOELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24OSi/c1-30-28-21-23-13-11-12-14-24(23)22-29(28)31(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-22H,1H3.
What are the key properties of (3-methoxynaphthalen-2-yl)-triphenylsilane?
(3-methoxynaphthalen-2-yl)-triphenylsilane has a molecular weight of 416.60 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxynaphthalen-2-yl)-triphenylsilane is sourced from PubChem (CID 4229060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).