CID 177406578

C14H16Se5Si2Sn2 — CID 177406578

IUPAC—
SMILESC[Si]([Se])([Se])[Si](C)([Se])[Se].[Se].[Sn]c1ccccc1.[Sn]c1ccccc1
InChIInChI=1S/2C6H5.C2H6Se4Si2.Se.2Sn/c2*1-2-4-6-5-3-1;1-7(3,4)8(2,5)6;;;/h2*1-5H;1-2H3;;;
InChIKeySDUMWOFWACYBLJ-UHFFFAOYSA-N
MW872.68 g/mol
LogP-0.54
Rot. Bonds1

About CID 177406578

CID 177406578 (PubChem CID 177406578) has the molecular formula C14H16Se5Si2Sn2 and a molecular weight of 872.68 g/mol.

Molecular Properties

Compound NameCID 177406578
PubChem CID177406578
Molecular FormulaC14H16Se5Si2Sn2
Molecular Weight872.68 g/mol
Exact Mass879.47
IUPAC Name—
SMILESC[Si]([Se])([Se])[Si](C)([Se])[Se].[Se].[Sn]c1ccccc1.[Sn]c1ccccc1
InChIInChI=1S/2C6H5.C2H6Se4Si2.Se.2Sn/c2*1-2-4-6-5-3-1;1-7(3,4)8(2,5)6;;;/h2*1-5H;1-2H3;;;
InChIKeySDUMWOFWACYBLJ-UHFFFAOYSA-N
XLogP-0.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500872.68
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 174327520
phenyl(trimethylsilyl)phosphanide
CID 12736257
CID 162252105
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tetramethylsilane;trimethyl(phenyl)silane
CID 161005748
CID 174443307
CID 174443307
dibromomethyl-dimethyl-phenylsilane
CID 11358731
CID 13412368
CID 13412368
trimethyl-[[methyl-phenyl-(trimethylsilylmethyl)silyl]methyl]silane
CID 101209454
dimethoxy-phenyl-(2-trimethylsilylethyl)silane
CID 59357473
[dimethyl(triphenylsilyl)silyl]-dimethyl-triphenylsilylsilane
CID 86205991

Frequently Asked Questions

What is the IUPAC name of CID 177406578?
The IUPAC name of CID 177406578 (CID 177406578) is not available.
What is the SMILES notation for CID 177406578?
The canonical SMILES for CID 177406578 is C[Si]([Se])([Se])[Si](C)([Se])[Se].[Se].[Sn]c1ccccc1.[Sn]c1ccccc1.
What is the InChIKey of CID 177406578?
The InChIKey is SDUMWOFWACYBLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H5.C2H6Se4Si2.Se.2Sn/c2*1-2-4-6-5-3-1;1-7(3,4)8(2,5)6;;;/h2*1-5H;1-2H3;;;.
What are the key properties of CID 177406578?
CID 177406578 has a molecular weight of 872.68 g/mol, XLogP of -0.54, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177406578 is sourced from PubChem (CID 177406578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).