dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane

C32H46S4Si2 — CID 101060108

IUPACdibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane
SMILESCCCC[Si](CCCC)(c1ccc(-c2cccs2)s1)[Si](CCCC)(CCCC)c1ccc(-c2cccs2)s1
InChIInChI=1S/C32H46S4Si2/c1-5-9-23-37(24-10-6-2,31-19-17-29(35-31)27-15-13-21-33-27)38(25-11-7-3,26-12-8-4)32-20-18-30(36-32)28-16-14-22-34-28/h13-22H,5-12,23-26H2,1-4H3
InChIKeyJASZVSDSYQILQU-UHFFFAOYSA-N
MW615.16 g/mol
LogP11.56
Rot. Bonds17

About dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane

dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane (PubChem CID 101060108) has the molecular formula C32H46S4Si2 and a molecular weight of 615.16 g/mol. Its IUPAC name is dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane.

Molecular Properties

Compound Namedibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane
PubChem CID101060108
Molecular FormulaC32H46S4Si2
Molecular Weight615.16 g/mol
Exact Mass614.20
IUPAC Namedibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane
SMILESCCCC[Si](CCCC)(c1ccc(-c2cccs2)s1)[Si](CCCC)(CCCC)c1ccc(-c2cccs2)s1
InChIInChI=1S/C32H46S4Si2/c1-5-9-23-37(24-10-6-2,31-19-17-29(35-31)27-15-13-21-33-27)38(25-11-7-3,26-12-8-4)32-20-18-30(36-32)28-16-14-22-34-28/h13-22H,5-12,23-26H2,1-4H3
InChIKeyJASZVSDSYQILQU-UHFFFAOYSA-N
XLogP11.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500615.16
LogP ≤ 511.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

bis[5-[5-[bis[5-(5-hexylthiophen-2-yl)thiophen-2-yl]-methylsilyl]thiophen-2-yl]thiophen-2-yl]-methyl-(5-thiophen-2-ylthiophen-2-yl)silane
CID 102519870
triethoxy-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]silane
CID 59664325
tetrakis[2-[dimethyl-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]silyl]ethyl]silane
CID 101345806
dichloro-methyl-(5-thiophen-2-ylthiophen-2-yl)silane
CID 25000318
2-methyl-5-thiophen-2-ylthiophene;propane
CID 142257628
2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
[5-[3-butyl-5-[4-butyl-5-[5-(4-butyl-5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-trimethylsilane
CID 10700156
2-(2-methylbutan-2-yl)-5-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
CID 129214307
2-propylsulfanyl-5-thiophen-2-ylthiophene
CID 100914409
2-[5-[5-(3,4-dioctyl-5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-3,4-dioctyl-5-thiophen-2-ylthiophene
CID 59188449
[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
CID 101486953
[5-[5-[5-[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
CID 101486956

Frequently Asked Questions

What is the IUPAC name of dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane?
The IUPAC name of dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane (CID 101060108) is dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane.
What is the SMILES notation for dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane?
The canonical SMILES for dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane is CCCC[Si](CCCC)(c1ccc(-c2cccs2)s1)[Si](CCCC)(CCCC)c1ccc(-c2cccs2)s1.
What is the InChIKey of dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane?
The InChIKey is JASZVSDSYQILQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H46S4Si2/c1-5-9-23-37(24-10-6-2,31-19-17-29(35-31)27-15-13-21-33-27)38(25-11-7-3,26-12-8-4)32-20-18-30(36-32)28-16-14-22-34-28/h13-22H,5-12,23-26H2,1-4H3.
What are the key properties of dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane?
dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane has a molecular weight of 615.16 g/mol, XLogP of 11.56, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane is sourced from PubChem (CID 101060108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).