methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane

C20H20Si — CID 12598487

IUPACmethyl-naphthalen-1-yl-phenyl-prop-2-enylsilane
SMILESC=CC[Si](C)(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C20H20Si/c1-3-16-21(2,18-12-5-4-6-13-18)20-15-9-11-17-10-7-8-14-19(17)20/h3-15H,1,16H2,2H3
InChIKeyFALMJDDFXSXOLJ-UHFFFAOYSA-N
MW288.47 g/mol
LogP4.22
Rot. Bonds4

About methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane

methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane (PubChem CID 12598487) has the molecular formula C20H20Si and a molecular weight of 288.47 g/mol. Its IUPAC name is methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane.

Molecular Properties

Compound Namemethyl-naphthalen-1-yl-phenyl-prop-2-enylsilane
PubChem CID12598487
Molecular FormulaC20H20Si
Molecular Weight288.47 g/mol
Exact Mass288.13
IUPAC Namemethyl-naphthalen-1-yl-phenyl-prop-2-enylsilane
SMILESC=CC[Si](C)(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C20H20Si/c1-3-16-21(2,18-12-5-4-6-13-18)20-15-9-11-17-10-7-8-14-19(17)20/h3-15H,1,16H2,2H3
InChIKeyFALMJDDFXSXOLJ-UHFFFAOYSA-N
XLogP4.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.47
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane?
The IUPAC name of methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane (CID 12598487) is methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane.
What is the SMILES notation for methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane?
The canonical SMILES for methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane is C=CC[Si](C)(c1ccccc1)c1cccc2ccccc12.
What is the InChIKey of methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane?
The InChIKey is FALMJDDFXSXOLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Si/c1-3-16-21(2,18-12-5-4-6-13-18)20-15-9-11-17-10-7-8-14-19(17)20/h3-15H,1,16H2,2H3.
What are the key properties of methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane?
methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane has a molecular weight of 288.47 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane is sourced from PubChem (CID 12598487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).