3-(3,5-dichlorophenyl)furan

C10H6Cl2O — CID 76539737

IUPAC3-(3,5-dichlorophenyl)furan
SMILESClc1cc(Cl)cc(-c2ccoc2)c1
InChIInChI=1S/C10H6Cl2O/c11-9-3-8(4-10(12)5-9)7-1-2-13-6-7/h1-6H
InChIKeyOIDBZVDBSUMDGG-UHFFFAOYSA-N
MW213.06 g/mol
LogP4.25
Rot. Bonds1

About 3-(3,5-dichlorophenyl)furan

3-(3,5-dichlorophenyl)furan (PubChem CID 76539737) has the molecular formula C10H6Cl2O and a molecular weight of 213.06 g/mol. Its IUPAC name is 3-(3,5-dichlorophenyl)furan.

Molecular Properties

Compound Name3-(3,5-dichlorophenyl)furan
PubChem CID76539737
Molecular FormulaC10H6Cl2O
Molecular Weight213.06 g/mol
Exact Mass211.98
IUPAC Name3-(3,5-dichlorophenyl)furan
SMILESClc1cc(Cl)cc(-c2ccoc2)c1
InChIInChI=1S/C10H6Cl2O/c11-9-3-8(4-10(12)5-9)7-1-2-13-6-7/h1-6H
InChIKeyOIDBZVDBSUMDGG-UHFFFAOYSA-N
XLogP4.25
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.06
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dichlorophenyl)furan?
The IUPAC name of 3-(3,5-dichlorophenyl)furan (CID 76539737) is 3-(3,5-dichlorophenyl)furan.
What is the SMILES notation for 3-(3,5-dichlorophenyl)furan?
The canonical SMILES for 3-(3,5-dichlorophenyl)furan is Clc1cc(Cl)cc(-c2ccoc2)c1.
What is the InChIKey of 3-(3,5-dichlorophenyl)furan?
The InChIKey is OIDBZVDBSUMDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2O/c11-9-3-8(4-10(12)5-9)7-1-2-13-6-7/h1-6H.
What are the key properties of 3-(3,5-dichlorophenyl)furan?
3-(3,5-dichlorophenyl)furan has a molecular weight of 213.06 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dichlorophenyl)furan is sourced from PubChem (CID 76539737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).