6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde

C15H10O3 — CID 59599736

IUPAC6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde
SMILESO=Cc1c(O)ccc2cc(-c3ccoc3)ccc12
InChIInChI=1S/C15H10O3/c16-8-14-13-3-1-10(12-5-6-18-9-12)7-11(13)2-4-15(14)17/h1-9,17H
InChIKeyAQTVUYSFYGRBFP-UHFFFAOYSA-N
MW238.24 g/mol
LogP3.62
Rot. Bonds2

About 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde

6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde (PubChem CID 59599736) has the molecular formula C15H10O3 and a molecular weight of 238.24 g/mol. Its IUPAC name is 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde.

Molecular Properties

Compound Name6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde
PubChem CID59599736
Molecular FormulaC15H10O3
Molecular Weight238.24 g/mol
Exact Mass238.06
IUPAC Name6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde
SMILESO=Cc1c(O)ccc2cc(-c3ccoc3)ccc12
InChIInChI=1S/C15H10O3/c16-8-14-13-3-1-10(12-5-6-18-9-12)7-11(13)2-4-15(14)17/h1-9,17H
InChIKeyAQTVUYSFYGRBFP-UHFFFAOYSA-N
XLogP3.62
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Beta-Naphthoflavone
CID 2361
Alpha-Naphthoflavone
CID 11790
2-Hydroxy-1-naphthaldehyde
CID 12819
6-Methoxy-2-naphthaldehyde
CID 76991
Phenyl 1-hydroxy-2-naphthoate
CID 67236
3-Methoxy-2-naphthoic acid
CID 70161
3-Hydroxynaphthalene-2-carbaldehyde
CID 315482
Benzo(b)naphtho(2,3-d)furan
CID 71072
6-Methoxy-2-Naphthoic Acid
CID 349181
Methyl 3-hydroxy-2-naphthoate
CID 70163
2-Naphthyl salicylate
CID 69182
1-Hydroxy-2-naphthaldehyde
CID 443195

Frequently Asked Questions

What is the IUPAC name of 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde?
The IUPAC name of 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde (CID 59599736) is 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde.
What is the SMILES notation for 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde?
The canonical SMILES for 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde is O=Cc1c(O)ccc2cc(-c3ccoc3)ccc12.
What is the InChIKey of 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde?
The InChIKey is AQTVUYSFYGRBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O3/c16-8-14-13-3-1-10(12-5-6-18-9-12)7-11(13)2-4-15(14)17/h1-9,17H.
What are the key properties of 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde?
6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde has a molecular weight of 238.24 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-3-yl)-2-hydroxynaphthalene-1-carbaldehyde is sourced from PubChem (CID 59599736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).