diphenyl-bis(2-phenylethynyl)silane

C28H20Si — CID 5213428

IUPACdiphenyl-bis(2-phenylethynyl)silane
SMILESC(#C[Si](C#Cc1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C28H20Si/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27,28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H
InChIKeyBBVOORFIXBLFFX-UHFFFAOYSA-N
MW384.55 g/mol
LogP4.43
Rot. Bonds2

About diphenyl-bis(2-phenylethynyl)silane

diphenyl-bis(2-phenylethynyl)silane (PubChem CID 5213428) has the molecular formula C28H20Si and a molecular weight of 384.55 g/mol. Its IUPAC name is diphenyl-bis(2-phenylethynyl)silane.

Molecular Properties

Compound Namediphenyl-bis(2-phenylethynyl)silane
PubChem CID5213428
Molecular FormulaC28H20Si
Molecular Weight384.55 g/mol
Exact Mass384.13
IUPAC Namediphenyl-bis(2-phenylethynyl)silane
SMILESC(#C[Si](C#Cc1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C28H20Si/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27,28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H
InChIKeyBBVOORFIXBLFFX-UHFFFAOYSA-N
XLogP4.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.55
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Benzene, 1,1',1'',1'''-(1,3-butadiene-1,4-diylidene)tetrakis-
CID 74060
1,1',1'',1'''-Silanetetrayltetrakis(benzene)
CID 66104
Tetraphenylethylene
CID 69437
Triphenyl(phenylethynyl)phosphonium
CID 3492871
1,1,2,2-Tetraphenylethane
CID 136454
Benzene, 1,1',1''-[(chlorosilylidyne)tris(methylene)]tris-
CID 87774
Benzene, 1,1',1'',1'''-(1,2-propadiene-1,3-diylidene)tetrakis-
CID 74290
Tribenzylsilane
CID 284134
1,4-Bis(2-phenylethynyl)benzene
CID 624226
1,1,3,3-Tetraphenyl-1-propene
CID 4682176
Antineoplastic-131518
CID 11145223
Triphenyl(phenylmethyl)phosphonium
CID 70672

Frequently Asked Questions

What is the IUPAC name of diphenyl-bis(2-phenylethynyl)silane?
The IUPAC name of diphenyl-bis(2-phenylethynyl)silane (CID 5213428) is diphenyl-bis(2-phenylethynyl)silane.
What is the SMILES notation for diphenyl-bis(2-phenylethynyl)silane?
The canonical SMILES for diphenyl-bis(2-phenylethynyl)silane is C(#C[Si](C#Cc1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl-bis(2-phenylethynyl)silane?
The InChIKey is BBVOORFIXBLFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20Si/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27,28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H.
What are the key properties of diphenyl-bis(2-phenylethynyl)silane?
diphenyl-bis(2-phenylethynyl)silane has a molecular weight of 384.55 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-bis(2-phenylethynyl)silane is sourced from PubChem (CID 5213428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).