dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane

C31H24OSi — CID 154182648

IUPACdinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane
SMILESc1ccc2cc(CO[SiH](c3cccc4ccccc34)c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C31H24OSi/c1-2-12-27-21-23(19-20-24(27)9-1)22-32-33(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-21,33H,22H2
InChIKeyNDVIZFDMKOKTIM-UHFFFAOYSA-N
MW440.62 g/mol
LogP6.20
Rot. Bonds5

About dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane

dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane (PubChem CID 154182648) has the molecular formula C31H24OSi and a molecular weight of 440.62 g/mol. Its IUPAC name is dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane.

Molecular Properties

Compound Namedinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane
PubChem CID154182648
Molecular FormulaC31H24OSi
Molecular Weight440.62 g/mol
Exact Mass440.16
IUPAC Namedinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane
SMILESc1ccc2cc(CO[SiH](c3cccc4ccccc34)c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C31H24OSi/c1-2-12-27-21-23(19-20-24(27)9-1)22-32-33(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-21,33H,22H2
InChIKeyNDVIZFDMKOKTIM-UHFFFAOYSA-N
XLogP6.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.62
LogP ≤ 56.20
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

1-(naphthalen-2-ylmethoxy)naphthalene
CID 132511538
2-(phosphorosooxymethyl)naphthalene
CID 69098049
2-(ethoxymethyl)naphthalene
CID 11063138
2-(naphthalen-2-ylmethyl)naphthalene
CID 14123480
anthracene;naphthalene;phenanthrene
CID 158591187
2-(cyclohexyloxymethyl)naphthalene
CID 10705229
1-(butoxymethyl)naphthalene;2-(butoxymethyl)naphthalene
CID 91406926
[3-(naphthalen-2-ylmethoxy)phenyl]methanol
CID 15778115
CID 57459119
CID 57459119
(2S,3S)-2-(naphthalen-2-ylmethoxy)-3-phenylmethoxyoxirane
CID 100966830
2-[(3-benzylphenyl)methyl]naphthalene
CID 157208363
2,6-dichloro-N-[4-(naphthalen-2-ylmethoxy)phenyl]aniline
CID 19813720

Frequently Asked Questions

What is the IUPAC name of dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane?
The IUPAC name of dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane (CID 154182648) is dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane.
What is the SMILES notation for dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane?
The canonical SMILES for dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane is c1ccc2cc(CO[SiH](c3cccc4ccccc34)c3cccc4ccccc34)ccc2c1.
What is the InChIKey of dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane?
The InChIKey is NDVIZFDMKOKTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24OSi/c1-2-12-27-21-23(19-20-24(27)9-1)22-32-33(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-21,33H,22H2.
What are the key properties of dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane?
dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane has a molecular weight of 440.62 g/mol, XLogP of 6.20, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dinaphthalen-1-yl(naphthalen-2-ylmethoxy)silane is sourced from PubChem (CID 154182648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).