3-chloro-2-(3-chlorothiophen-2-yl)thiophene

C8H4Cl2S2 — CID 15311722

IUPAC3-chloro-2-(3-chlorothiophen-2-yl)thiophene
SMILESClc1ccsc1-c1sccc1Cl
InChIInChI=1S/C8H4Cl2S2/c9-5-1-3-11-7(5)8-6(10)2-4-12-8/h1-4H
InChIKeyLRQRJVDRVMEFFR-UHFFFAOYSA-N
MW235.16 g/mol
LogP4.78
Rot. Bonds1

About 3-chloro-2-(3-chlorothiophen-2-yl)thiophene

3-chloro-2-(3-chlorothiophen-2-yl)thiophene (PubChem CID 15311722) has the molecular formula C8H4Cl2S2 and a molecular weight of 235.16 g/mol. Its IUPAC name is 3-chloro-2-(3-chlorothiophen-2-yl)thiophene.

Molecular Properties

Compound Name3-chloro-2-(3-chlorothiophen-2-yl)thiophene
PubChem CID15311722
Molecular FormulaC8H4Cl2S2
Molecular Weight235.16 g/mol
Exact Mass233.91
IUPAC Name3-chloro-2-(3-chlorothiophen-2-yl)thiophene
SMILESClc1ccsc1-c1sccc1Cl
InChIInChI=1S/C8H4Cl2S2/c9-5-1-3-11-7(5)8-6(10)2-4-12-8/h1-4H
InChIKeyLRQRJVDRVMEFFR-UHFFFAOYSA-N
XLogP4.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.16
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(3-chlorothiophen-2-yl)thiophene?
The IUPAC name of 3-chloro-2-(3-chlorothiophen-2-yl)thiophene (CID 15311722) is 3-chloro-2-(3-chlorothiophen-2-yl)thiophene.
What is the SMILES notation for 3-chloro-2-(3-chlorothiophen-2-yl)thiophene?
The canonical SMILES for 3-chloro-2-(3-chlorothiophen-2-yl)thiophene is Clc1ccsc1-c1sccc1Cl.
What is the InChIKey of 3-chloro-2-(3-chlorothiophen-2-yl)thiophene?
The InChIKey is LRQRJVDRVMEFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2S2/c9-5-1-3-11-7(5)8-6(10)2-4-12-8/h1-4H.
What are the key properties of 3-chloro-2-(3-chlorothiophen-2-yl)thiophene?
3-chloro-2-(3-chlorothiophen-2-yl)thiophene has a molecular weight of 235.16 g/mol, XLogP of 4.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(3-chlorothiophen-2-yl)thiophene is sourced from PubChem (CID 15311722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).