bis[(2-methyl-1-phenylinden-1-yl)methyl]silane

C34H32Si — CID 137328534

IUPACbis[(2-methyl-1-phenylinden-1-yl)methyl]silane
SMILESCC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(C)=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C34H32Si/c1-25-21-27-13-9-11-19-31(27)33(25,29-15-5-3-6-16-29)23-35-24-34(30-17-7-4-8-18-30)26(2)22-28-14-10-12-20-32(28)34/h3-22H,23-24,35H2,1-2H3
InChIKeyRSZVEJOIWRVNLF-UHFFFAOYSA-N
MW468.72 g/mol
LogP7.80
Rot. Bonds6

About bis[(2-methyl-1-phenylinden-1-yl)methyl]silane

bis[(2-methyl-1-phenylinden-1-yl)methyl]silane (PubChem CID 137328534) has the molecular formula C34H32Si and a molecular weight of 468.72 g/mol. Its IUPAC name is bis[(2-methyl-1-phenylinden-1-yl)methyl]silane.

Molecular Properties

Compound Namebis[(2-methyl-1-phenylinden-1-yl)methyl]silane
PubChem CID137328534
Molecular FormulaC34H32Si
Molecular Weight468.72 g/mol
Exact Mass468.23
IUPAC Namebis[(2-methyl-1-phenylinden-1-yl)methyl]silane
SMILESCC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(C)=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C34H32Si/c1-25-21-27-13-9-11-19-31(27)33(25,29-15-5-3-6-16-29)23-35-24-34(30-17-7-4-8-18-30)26(2)22-28-14-10-12-20-32(28)34/h3-22H,23-24,35H2,1-2H3
InChIKeyRSZVEJOIWRVNLF-UHFFFAOYSA-N
XLogP7.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.72
LogP ≤ 57.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis[(2-methyl-1-phenylinden-1-yl)methyl]silane?
The IUPAC name of bis[(2-methyl-1-phenylinden-1-yl)methyl]silane (CID 137328534) is bis[(2-methyl-1-phenylinden-1-yl)methyl]silane.
What is the SMILES notation for bis[(2-methyl-1-phenylinden-1-yl)methyl]silane?
The canonical SMILES for bis[(2-methyl-1-phenylinden-1-yl)methyl]silane is CC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(C)=Cc2ccccc21)c1ccccc1.
What is the InChIKey of bis[(2-methyl-1-phenylinden-1-yl)methyl]silane?
The InChIKey is RSZVEJOIWRVNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32Si/c1-25-21-27-13-9-11-19-31(27)33(25,29-15-5-3-6-16-29)23-35-24-34(30-17-7-4-8-18-30)26(2)22-28-14-10-12-20-32(28)34/h3-22H,23-24,35H2,1-2H3.
What are the key properties of bis[(2-methyl-1-phenylinden-1-yl)methyl]silane?
bis[(2-methyl-1-phenylinden-1-yl)methyl]silane has a molecular weight of 468.72 g/mol, XLogP of 7.80, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(2-methyl-1-phenylinden-1-yl)methyl]silane is sourced from PubChem (CID 137328534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).