5-(2-chlorophenyl)furan-2-carbaldehyde

C11H7ClO2 — CID 609821

IUPAC5-(2-chlorophenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C11H7ClO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
InChIKeyONQOZTFAOFZDFK-UHFFFAOYSA-N
MW206.63 g/mol
LogP3.41
Rot. Bonds2

About 5-(2-chlorophenyl)furan-2-carbaldehyde

5-(2-chlorophenyl)furan-2-carbaldehyde (PubChem CID 609821) has the molecular formula C11H7ClO2 and a molecular weight of 206.63 g/mol. Its IUPAC name is 5-(2-chlorophenyl)furan-2-carbaldehyde.

Molecular Properties

Compound Name5-(2-chlorophenyl)furan-2-carbaldehyde
PubChem CID609821
Molecular FormulaC11H7ClO2
Molecular Weight206.63 g/mol
Exact Mass206.01
IUPAC Name5-(2-chlorophenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C11H7ClO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
InChIKeyONQOZTFAOFZDFK-UHFFFAOYSA-N
XLogP3.41
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.63
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)furan-2-carbaldehyde?
The IUPAC name of 5-(2-chlorophenyl)furan-2-carbaldehyde (CID 609821) is 5-(2-chlorophenyl)furan-2-carbaldehyde.
What is the SMILES notation for 5-(2-chlorophenyl)furan-2-carbaldehyde?
The canonical SMILES for 5-(2-chlorophenyl)furan-2-carbaldehyde is O=Cc1ccc(-c2ccccc2Cl)o1.
What is the InChIKey of 5-(2-chlorophenyl)furan-2-carbaldehyde?
The InChIKey is ONQOZTFAOFZDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H.
What are the key properties of 5-(2-chlorophenyl)furan-2-carbaldehyde?
5-(2-chlorophenyl)furan-2-carbaldehyde has a molecular weight of 206.63 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)furan-2-carbaldehyde is sourced from PubChem (CID 609821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).