2,5-bis(4-chlorophenyl)thiophene

C16H10Cl2S — CID 3588046

IUPAC2,5-bis(4-chlorophenyl)thiophene
SMILESClc1ccc(-c2ccc(-c3ccc(Cl)cc3)s2)cc1
InChIInChI=1S/C16H10Cl2S/c17-13-5-1-11(2-6-13)15-9-10-16(19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyOAMKIKJEEIPWSI-UHFFFAOYSA-N
MW305.23 g/mol
LogP6.39
Rot. Bonds2

About 2,5-bis(4-chlorophenyl)thiophene

2,5-bis(4-chlorophenyl)thiophene (PubChem CID 3588046) has the molecular formula C16H10Cl2S and a molecular weight of 305.23 g/mol. Its IUPAC name is 2,5-bis(4-chlorophenyl)thiophene.

Molecular Properties

Compound Name2,5-bis(4-chlorophenyl)thiophene
PubChem CID3588046
Molecular FormulaC16H10Cl2S
Molecular Weight305.23 g/mol
Exact Mass303.99
IUPAC Name2,5-bis(4-chlorophenyl)thiophene
SMILESClc1ccc(-c2ccc(-c3ccc(Cl)cc3)s2)cc1
InChIInChI=1S/C16H10Cl2S/c17-13-5-1-11(2-6-13)15-9-10-16(19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyOAMKIKJEEIPWSI-UHFFFAOYSA-N
XLogP6.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.23
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-Diphenylthiophene
CID 74050
2-[(E)-2-(4-chlorophenyl)ethenyl]-5-thiophen-2-ylthiophene
CID 15616762
Benzo(b)thiophene, chloro-
CID 46371
2-[(E)-2-(4-chlorophenyl)ethenyl]-5-(5-iodothiophen-2-yl)thiophene
CID 53330302
2-[Bis(4-chlorophenyl)methylsulfinylmethyl]thiophene
CID 137633195
2-(Benzhydrylsulfinylmethyl)-3-chlorothiophene
CID 137649584
3-(4-Chlorophenyl)-1lambda(4),2-dithiol-5-yl methyl sulfide
CID 494170
2-(3-Chlorophenyl)-1-benzothiophene
CID 46228137
4-[5-(4-Chlorophenyl)thiophen-2-yl]-2-fluorobenzonitrile
CID 137651571
2-(Benzhydrylsulfinylmethyl)-5-chlorothiophene
CID 137656786
2-Allylsulfanyl-5-(4-chlorophenyl)-3-(trifluoromethyl)thiophene
CID 129708949
Triarathene
CID 6450825

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-chlorophenyl)thiophene?
The IUPAC name of 2,5-bis(4-chlorophenyl)thiophene (CID 3588046) is 2,5-bis(4-chlorophenyl)thiophene.
What is the SMILES notation for 2,5-bis(4-chlorophenyl)thiophene?
The canonical SMILES for 2,5-bis(4-chlorophenyl)thiophene is Clc1ccc(-c2ccc(-c3ccc(Cl)cc3)s2)cc1.
What is the InChIKey of 2,5-bis(4-chlorophenyl)thiophene?
The InChIKey is OAMKIKJEEIPWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2S/c17-13-5-1-11(2-6-13)15-9-10-16(19-15)12-3-7-14(18)8-4-12/h1-10H.
What are the key properties of 2,5-bis(4-chlorophenyl)thiophene?
2,5-bis(4-chlorophenyl)thiophene has a molecular weight of 305.23 g/mol, XLogP of 6.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-chlorophenyl)thiophene is sourced from PubChem (CID 3588046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).