2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole

C28H26Si — CID 59096237

IUPAC2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole
SMILESCc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c(C)cc1-2
InChIInChI=1S/C28H26Si/c1-19-15-25-26-16-20(2)22(4)18-28(26)29(27(25)17-21(19)3,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-18H,1-4H3
InChIKeyZHZBJJUKQODAOH-UHFFFAOYSA-N
MW390.60 g/mol
LogP4.28
Rot. Bonds2

About 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole

2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole (PubChem CID 59096237) has the molecular formula C28H26Si and a molecular weight of 390.60 g/mol. Its IUPAC name is 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole.

Molecular Properties

Compound Name2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole
PubChem CID59096237
Molecular FormulaC28H26Si
Molecular Weight390.60 g/mol
Exact Mass390.18
IUPAC Name2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole
SMILESCc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c(C)cc1-2
InChIInChI=1S/C28H26Si/c1-19-15-25-26-16-20(2)22(4)18-28(26)29(27(25)17-21(19)3,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-18H,1-4H3
InChIKeyZHZBJJUKQODAOH-UHFFFAOYSA-N
XLogP4.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.60
LogP ≤ 54.28
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

3,7-dimethyl-5,5-diphenylbenzo[b][1]benzosilole
CID 59167435
1-[3,7-dimethyl-5,5-diphenyl-2-(phenyliminomethyl)benzo[b][1]benzosilol-8-yl]-N-phenylmethanimine
CID 59167438
5-(2-methylphenyl)-5-phenylbenzo[b][1]benzosilole
CID 58711206
5,5-diphenyl-2,8-bis(2,4,6-trimethylphenyl)benzo[b][1]benzosilole
CID 177091641
5-(4-methylphenyl)-5-phenylnaphtho[2,3-b][1]benzosilole
CID 153488427
18-methyl-10,10-diphenyl-10-silapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 153488342
7-methyl-5,5-diphenylanthra[2,1-b][1]benzosilole
CID 153488362
5,14-dimethyl-8,8-diphenyl-8-silatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene
CID 176637820
10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline
CID 59167350
2,8-bis(3,5-diphenylphenyl)-5,5-diphenylbenzo[b][1]benzosilole
CID 58971395
5-[4-[4-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-methylphenyl]-3-methylphenyl]-10,10-diphenylbenzo[b][1,4]benzazasiline
CID 140856445
2-methoxy-3,8-dimethyl-5,5,6,6-tetraphenylbenzo[c][1,2]benzodisiline
CID 59167389

Frequently Asked Questions

What is the IUPAC name of 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole?
The IUPAC name of 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole (CID 59096237) is 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole.
What is the SMILES notation for 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole?
The canonical SMILES for 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole is Cc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c(C)cc1-2.
What is the InChIKey of 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole?
The InChIKey is ZHZBJJUKQODAOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26Si/c1-19-15-25-26-16-20(2)22(4)18-28(26)29(27(25)17-21(19)3,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-18H,1-4H3.
What are the key properties of 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole?
2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole has a molecular weight of 390.60 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,7,8-tetramethyl-5,5-diphenylbenzo[b][1]benzosilole is sourced from PubChem (CID 59096237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).