3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene

C8H2Cl4S2 — CID 2740604

IUPAC3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene
SMILESClc1cc(Cl)c(-c2sc(Cl)cc2Cl)s1
InChIInChI=1S/C8H2Cl4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H
InChIKeyZKNJXGDZEIJPSV-UHFFFAOYSA-N
MW304.05 g/mol
LogP6.09
Rot. Bonds1

About 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene

3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene (PubChem CID 2740604) has the molecular formula C8H2Cl4S2 and a molecular weight of 304.05 g/mol. Its IUPAC name is 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene.

Molecular Properties

Compound Name3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene
PubChem CID2740604
Molecular FormulaC8H2Cl4S2
Molecular Weight304.05 g/mol
Exact Mass301.84
IUPAC Name3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene
SMILESClc1cc(Cl)c(-c2sc(Cl)cc2Cl)s1
InChIInChI=1S/C8H2Cl4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H
InChIKeyZKNJXGDZEIJPSV-UHFFFAOYSA-N
XLogP6.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.05
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 58729678
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CID 85616415
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CID 141487066
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CID 66608670
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CID 7832025
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CID 12063628
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CID 12792431
CID 12792431

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene?
The IUPAC name of 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene (CID 2740604) is 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene.
What is the SMILES notation for 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene?
The canonical SMILES for 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene is Clc1cc(Cl)c(-c2sc(Cl)cc2Cl)s1.
What is the InChIKey of 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene?
The InChIKey is ZKNJXGDZEIJPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H2Cl4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H.
What are the key properties of 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene?
3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene has a molecular weight of 304.05 g/mol, XLogP of 6.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-(3,5-dichlorothiophen-2-yl)thiophene is sourced from PubChem (CID 2740604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).