5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde

C18H14O3 — CID 58838892

IUPAC5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde
SMILESCOc1cccc(-c2ccccc2-c2ccc(C=O)o2)c1
InChIInChI=1S/C18H14O3/c1-20-14-6-4-5-13(11-14)16-7-2-3-8-17(16)18-10-9-15(12-19)21-18/h2-12H,1H3
InChIKeyOJPZGHJPNCWIPP-UHFFFAOYSA-N
MW278.31 g/mol
LogP4.43
Rot. Bonds4

About 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde

5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde (PubChem CID 58838892) has the molecular formula C18H14O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde.

Molecular Properties

Compound Name5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde
PubChem CID58838892
Molecular FormulaC18H14O3
Molecular Weight278.31 g/mol
Exact Mass278.09
IUPAC Name5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde
SMILESCOc1cccc(-c2ccccc2-c2ccc(C=O)o2)c1
InChIInChI=1S/C18H14O3/c1-20-14-6-4-5-13(11-14)16-7-2-3-8-17(16)18-10-9-15(12-19)21-18/h2-12H,1H3
InChIKeyOJPZGHJPNCWIPP-UHFFFAOYSA-N
XLogP4.43
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(3,4-difluorophenyl)phenyl]furan-2-carbaldehyde
CID 169333066
5-(2-iodo-4-methoxyphenyl)furan-2-carbaldehyde
CID 169332115
4-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-5-one
CID 1296712
(5Z)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-4-one
CID 21229558
5-[4-(2-methoxyphenyl)phenyl]furan-2-carbaldehyde
CID 169332736
3-(5-formylfuran-2-yl)-2-(4-methoxyphenyl)benzoic acid
CID 169335175
5-(3-cyclopropyloxyphenyl)furan-2-carbaldehyde
CID 106886623
2-(5-formylfuran-2-yl)-4-methoxybenzenesulfonic acid
CID 169334858
2-[2-(3-methoxyphenyl)phenyl]phenol
CID 135057832
3-(3-methoxyphenyl)-1-methylpyrrole-2-carbaldehyde
CID 125456181
5-(3-pyridin-2-yloxyphenyl)furan-2-carbaldehyde
CID 169333182
5-[3-(4-fluorophenoxy)phenyl]furan-2-carbaldehyde
CID 169334086

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde?
The IUPAC name of 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde (CID 58838892) is 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde.
What is the SMILES notation for 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde?
The canonical SMILES for 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde is COc1cccc(-c2ccccc2-c2ccc(C=O)o2)c1.
What is the InChIKey of 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde?
The InChIKey is OJPZGHJPNCWIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O3/c1-20-14-6-4-5-13(11-14)16-7-2-3-8-17(16)18-10-9-15(12-19)21-18/h2-12H,1H3.
What are the key properties of 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde?
5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde has a molecular weight of 278.31 g/mol, XLogP of 4.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde is sourced from PubChem (CID 58838892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).