trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane

C34H38Si2Sn — CID 166436968

IUPACtrimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane
SMILESC[Si](C)(C)C1=C(c2ccccc2)C(c2ccccc2)=C([Si](C)(C)C)[Sn]1(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28Si2.2C6H5.Sn/c1-23(2,3)17-21(19-13-9-7-10-14-19)22(18-24(4,5)6)20-15-11-8-12-16-20;2*1-2-4-6-5-3-1;/h7-16H,1-6H3;2*1-5H;
InChIKeyBWHLKWQBZNQGHG-UHFFFAOYSA-N
MW621.56 g/mol
LogP8.00
Rot. Bonds6

About trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane

trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane (PubChem CID 166436968) has the molecular formula C34H38Si2Sn and a molecular weight of 621.56 g/mol. Its IUPAC name is trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane.

Molecular Properties

Compound Nametrimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane
PubChem CID166436968
Molecular FormulaC34H38Si2Sn
Molecular Weight621.56 g/mol
Exact Mass622.15
IUPAC Nametrimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane
SMILESC[Si](C)(C)C1=C(c2ccccc2)C(c2ccccc2)=C([Si](C)(C)C)[Sn]1(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28Si2.2C6H5.Sn/c1-23(2,3)17-21(19-13-9-7-10-14-19)22(18-24(4,5)6)20-15-11-8-12-16-20;2*1-2-4-6-5-3-1;/h7-16H,1-6H3;2*1-5H;
InChIKeyBWHLKWQBZNQGHG-UHFFFAOYSA-N
XLogP8.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms37
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500621.56
LogP ≤ 58.00
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 trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane?
The IUPAC name of trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane (CID 166436968) is trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane.
What is the SMILES notation for trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane?
The canonical SMILES for trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane is C[Si](C)(C)C1=C(c2ccccc2)C(c2ccccc2)=C([Si](C)(C)C)[Sn]1(c1ccccc1)c1ccccc1.
What is the InChIKey of trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane?
The InChIKey is BWHLKWQBZNQGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28Si2.2C6H5.Sn/c1-23(2,3)17-21(19-13-9-7-10-14-19)22(18-24(4,5)6)20-15-11-8-12-16-20;2*1-2-4-6-5-3-1;/h7-16H,1-6H3;2*1-5H;.
What are the key properties of trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane?
trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane has a molecular weight of 621.56 g/mol, XLogP of 8.00, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(1,1,3,4-tetraphenyl-5-trimethylsilylstannol-2-yl)silane is sourced from PubChem (CID 166436968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).