cyclobuten-1-yl(triphenyl)silane

C22H20Si — CID 71421522

IUPACcyclobuten-1-yl(triphenyl)silane
SMILESC1=C([Si](c2ccccc2)(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H20Si/c1-4-11-19(12-5-1)23(22-17-10-18-22,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-9,11-17H,10,18H2
InChIKeyBMUYIMFGWRDZPU-UHFFFAOYSA-N
MW312.49 g/mol
LogP3.42
Rot. Bonds4

About cyclobuten-1-yl(triphenyl)silane

cyclobuten-1-yl(triphenyl)silane (PubChem CID 71421522) has the molecular formula C22H20Si and a molecular weight of 312.49 g/mol. Its IUPAC name is cyclobuten-1-yl(triphenyl)silane.

Molecular Properties

Compound Namecyclobuten-1-yl(triphenyl)silane
PubChem CID71421522
Molecular FormulaC22H20Si
Molecular Weight312.49 g/mol
Exact Mass312.13
IUPAC Namecyclobuten-1-yl(triphenyl)silane
SMILESC1=C([Si](c2ccccc2)(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H20Si/c1-4-11-19(12-5-1)23(22-17-10-18-22,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-9,11-17H,10,18H2
InChIKeyBMUYIMFGWRDZPU-UHFFFAOYSA-N
XLogP3.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.49
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(8-bromo-5,6-dihydronaphthalen-2-yl)-triphenylsilane
CID 71446280
(3-methylcyclopenta-1,3-dien-1-yl)-(4-methylphenyl)-diphenylsilane
CID 123595310
[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-triphenylsilane
CID 10884277
di(cyclopenta-1,3-dien-1-yl)-diphenylsilane
CID 18430524
3-[(3-aminophenyl)-diphenylsilyl]aniline
CID 139628514
tert-butyl-(cyclohexen-1-yl)-diphenylsilane
CID 11301658
tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane
CID 10989040
dichloro-cyclohexa-1,3-dien-1-yl-phenylsilane
CID 90322017
triphenyl-[4-[(E)-2-[4-[(E)-2-(4-triphenylsilylphenyl)ethenyl]phenyl]ethenyl]phenyl]silane
CID 101341484
CID 10893883
CID 10893883
cyclopenta-1,3-dien-1-yl-(3-methylphenyl)-diphenylsilane
CID 21188975
CID 158909603
CID 158909603

Frequently Asked Questions

What is the IUPAC name of cyclobuten-1-yl(triphenyl)silane?
The IUPAC name of cyclobuten-1-yl(triphenyl)silane (CID 71421522) is cyclobuten-1-yl(triphenyl)silane.
What is the SMILES notation for cyclobuten-1-yl(triphenyl)silane?
The canonical SMILES for cyclobuten-1-yl(triphenyl)silane is C1=C([Si](c2ccccc2)(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of cyclobuten-1-yl(triphenyl)silane?
The InChIKey is BMUYIMFGWRDZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20Si/c1-4-11-19(12-5-1)23(22-17-10-18-22,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-9,11-17H,10,18H2.
What are the key properties of cyclobuten-1-yl(triphenyl)silane?
cyclobuten-1-yl(triphenyl)silane has a molecular weight of 312.49 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobuten-1-yl(triphenyl)silane is sourced from PubChem (CID 71421522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).