dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene

C29H32Si — CID 159821402

IUPACdimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene
SMILESCC(C)(c1ccccc1)c1ccccc1.C[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16.C14H16Si/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2*3-12H,1-2H3
InChIKeyNMHASRXSZXVSME-UHFFFAOYSA-N
MW408.66 g/mol
LogP6.52
Rot. Bonds4

About dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene

dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene (PubChem CID 159821402) has the molecular formula C29H32Si and a molecular weight of 408.66 g/mol. Its IUPAC name is dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene.

Molecular Properties

Compound Namedimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene
PubChem CID159821402
Molecular FormulaC29H32Si
Molecular Weight408.66 g/mol
Exact Mass408.23
IUPAC Namedimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene
SMILESCC(C)(c1ccccc1)c1ccccc1.C[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16.C14H16Si/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2*3-12H,1-2H3
InChIKeyNMHASRXSZXVSME-UHFFFAOYSA-N
XLogP6.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.66
LogP ≤ 56.52
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 dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene?
The IUPAC name of dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene (CID 159821402) is dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene.
What is the SMILES notation for dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene?
The canonical SMILES for dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene is CC(C)(c1ccccc1)c1ccccc1.C[Si](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene?
The InChIKey is NMHASRXSZXVSME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16.C14H16Si/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2*3-12H,1-2H3.
What are the key properties of dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene?
dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene has a molecular weight of 408.66 g/mol, XLogP of 6.52, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene is sourced from PubChem (CID 159821402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).