methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane

C21H24OSi — CID 10990843

IUPACmethyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane
SMILESCC(C)(C)O[Si@@](C)(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C21H24OSi/c1-21(2,3)22-23(4,18-13-6-5-7-14-18)20-16-10-12-17-11-8-9-15-19(17)20/h5-16H,1-4H3/t23-/m0/s1
InChIKeyPIANCZJEMWUAHK-QHCPKHFHSA-N
MW320.51 g/mol
LogP4.34
Rot. Bonds3

About methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane

methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane (PubChem CID 10990843) has the molecular formula C21H24OSi and a molecular weight of 320.51 g/mol. Its IUPAC name is methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane.

Molecular Properties

Compound Namemethyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane
PubChem CID10990843
Molecular FormulaC21H24OSi
Molecular Weight320.51 g/mol
Exact Mass320.16
IUPAC Namemethyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane
SMILESCC(C)(C)O[Si@@](C)(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C21H24OSi/c1-21(2,3)22-23(4,18-13-6-5-7-14-18)20-16-10-12-17-11-8-9-15-19(17)20/h5-16H,1-4H3/t23-/m0/s1
InChIKeyPIANCZJEMWUAHK-QHCPKHFHSA-N
XLogP4.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.51
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

bis[2-(hydroxy-naphthalen-1-yl-phenylsilyl)ethyl]-dimethylsilane
CID 102005003
chloro-methyl-dinaphthalen-1-ylsilane
CID 140861802
methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane
CID 12598487
ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane
CID 66774383
dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane
CID 14490056
(2-methylpropan-2-yl)oxy-[4-[(2-methylpropan-2-yl)oxy-diphenylsilyl]phenyl]-diphenylsilane
CID 87143933
(4-ethynylphenyl)-methyl-naphthalen-1-yl-phenylsilane
CID 101072929
(1R)-N-(methyl-naphthalen-1-yl-phenylsilyl)-1-phenyl-N-[(1R)-1-phenylethyl]ethanamine
CID 100943831
dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane
CID 12030742
naphthalen-1-yl-(2-naphthalen-1-ylbutyl)-diphenylsilane
CID 151935295
butyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane
CID 66773716
dichloro-ethyl-naphthalen-1-ylsilane
CID 90259567

Frequently Asked Questions

What is the IUPAC name of methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane?
The IUPAC name of methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane (CID 10990843) is methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane.
What is the SMILES notation for methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane?
The canonical SMILES for methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane is CC(C)(C)O[Si@@](C)(c1ccccc1)c1cccc2ccccc12.
What is the InChIKey of methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane?
The InChIKey is PIANCZJEMWUAHK-QHCPKHFHSA-N. The full InChI is InChI=1S/C21H24OSi/c1-21(2,3)22-23(4,18-13-6-5-7-14-18)20-16-10-12-17-11-8-9-15-19(17)20/h5-16H,1-4H3/t23-/m0/s1.
What are the key properties of methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane?
methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane has a molecular weight of 320.51 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane is sourced from PubChem (CID 10990843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).