5-(2-fluorophenyl)furan-2-carbaldehyde

C11H7FO2 — CID 960559

IUPAC5-(2-fluorophenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2F)o1
InChIInChI=1S/C11H7FO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
InChIKeyKGGOAPVMWNGAQS-UHFFFAOYSA-N
MW190.17 g/mol
LogP2.90
Rot. Bonds2

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

5-(2-fluorophenyl)furan-2-carbaldehyde (PubChem CID 960559) has the molecular formula C11H7FO2 and a molecular weight of 190.17 g/mol. Its IUPAC name is 5-(2-fluorophenyl)furan-2-carbaldehyde.

Molecular Properties

Compound Name5-(2-fluorophenyl)furan-2-carbaldehyde
PubChem CID960559
Molecular FormulaC11H7FO2
Molecular Weight190.17 g/mol
Exact Mass190.04
IUPAC Name5-(2-fluorophenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2F)o1
InChIInChI=1S/C11H7FO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
InChIKeyKGGOAPVMWNGAQS-UHFFFAOYSA-N
XLogP2.90
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Benzofurancarboxaldehyde
CID 61341
2-Furyl pentyl ketone
CID 61738
2-Butyrylfuran
CID 228588
2-Pentanoylfuran
CID 231325
Phenethyl 2-furoate
CID 251531
2-Phenyl-3-(2-furyl)prop-2-enal
CID 6435876
2-Acetylbenzofuran
CID 15435
1-Benzofuran-5-carbaldehyde
CID 2773875
Ethanone, 1-(3-methyl-2-benzofuranyl)-
CID 2507689
2-Propyn-1-one, 1-(2-furanyl)-3-phenyl-
CID 200953
Acrylophenone, 3-(2-furyl)-
CID 5354164
Benzoic acid, 4-(5-formyl-2-furanyl)-, ethyl ester
CID 608139

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)furan-2-carbaldehyde?
The IUPAC name of 5-(2-fluorophenyl)furan-2-carbaldehyde (CID 960559) is 5-(2-fluorophenyl)furan-2-carbaldehyde.
What is the SMILES notation for 5-(2-fluorophenyl)furan-2-carbaldehyde?
The canonical SMILES for 5-(2-fluorophenyl)furan-2-carbaldehyde is O=Cc1ccc(-c2ccccc2F)o1.
What is the InChIKey of 5-(2-fluorophenyl)furan-2-carbaldehyde?
The InChIKey is KGGOAPVMWNGAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FO2/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-fluorophenyl)furan-2-carbaldehyde?
5-(2-fluorophenyl)furan-2-carbaldehyde has a molecular weight of 190.17 g/mol, XLogP of 2.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)furan-2-carbaldehyde is sourced from PubChem (CID 960559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).