2-(1,2,2-trithiophen-2-ylethenyl)thiophene

C18H12S4 — CID 15249530

IUPAC2-(1,2,2-trithiophen-2-ylethenyl)thiophene
SMILESc1csc(C(=C(c2cccs2)c2cccs2)c2cccs2)c1
InChIInChI=1S/C18H12S4/c1-5-13(19-9-1)17(14-6-2-10-20-14)18(15-7-3-11-21-15)16-8-4-12-22-16/h1-12H
InChIKeyHNHRZULVAOZEJG-UHFFFAOYSA-N
MW356.56 g/mol
LogP6.94
Rot. Bonds4

About 2-(1,2,2-trithiophen-2-ylethenyl)thiophene

2-(1,2,2-trithiophen-2-ylethenyl)thiophene (PubChem CID 15249530) has the molecular formula C18H12S4 and a molecular weight of 356.56 g/mol. Its IUPAC name is 2-(1,2,2-trithiophen-2-ylethenyl)thiophene.

Molecular Properties

Compound Name2-(1,2,2-trithiophen-2-ylethenyl)thiophene
PubChem CID15249530
Molecular FormulaC18H12S4
Molecular Weight356.56 g/mol
Exact Mass355.98
IUPAC Name2-(1,2,2-trithiophen-2-ylethenyl)thiophene
SMILESc1csc(C(=C(c2cccs2)c2cccs2)c2cccs2)c1
InChIInChI=1S/C18H12S4/c1-5-13(19-9-1)17(14-6-2-10-20-14)18(15-7-3-11-21-15)16-8-4-12-22-16/h1-12H
InChIKeyHNHRZULVAOZEJG-UHFFFAOYSA-N
XLogP6.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.56
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(E)-1,2-diphenyl-2-thiophen-2-ylethenyl]thiophene
CID 10688838
S-hydroxy thiophene-2-carbothioate
CID 134893534
ethene;2-(1-thiophen-2-ylethenyl)thiophene
CID 174797517
2-(1-thiophen-2-ylprop-1-enyl)thiophene
CID 154192160
thiophene-2-carboxylic acid;dihydrochloride
CID 142681507
N-(dithiophen-2-ylmethylidene)hydroxylamine
CID 2775140
CID 11204853
CID 11204853
1-thiophen-2-ylprop-1-en-1-ol
CID 68622229
formaldehyde;thiophene-2-carboxylic acid
CID 158716916
sodium thiophene-2-carboxylate
CID 23672340
2-[cyclopenta-2,4-dien-1-ylidene(thiophen-2-yl)methyl]thiophene
CID 11139311
oxo(thiophen-2-yl)methanesulfinic acid
CID 175422247

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,2-trithiophen-2-ylethenyl)thiophene?
The IUPAC name of 2-(1,2,2-trithiophen-2-ylethenyl)thiophene (CID 15249530) is 2-(1,2,2-trithiophen-2-ylethenyl)thiophene.
What is the SMILES notation for 2-(1,2,2-trithiophen-2-ylethenyl)thiophene?
The canonical SMILES for 2-(1,2,2-trithiophen-2-ylethenyl)thiophene is c1csc(C(=C(c2cccs2)c2cccs2)c2cccs2)c1.
What is the InChIKey of 2-(1,2,2-trithiophen-2-ylethenyl)thiophene?
The InChIKey is HNHRZULVAOZEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12S4/c1-5-13(19-9-1)17(14-6-2-10-20-14)18(15-7-3-11-21-15)16-8-4-12-22-16/h1-12H.
What are the key properties of 2-(1,2,2-trithiophen-2-ylethenyl)thiophene?
2-(1,2,2-trithiophen-2-ylethenyl)thiophene has a molecular weight of 356.56 g/mol, XLogP of 6.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,2-trithiophen-2-ylethenyl)thiophene is sourced from PubChem (CID 15249530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).