5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde

C19H16O3 — CID 122358652

IUPAC5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde
SMILESCCOc1ccc2cc(-c3ccc(O)c(C=O)c3)ccc2c1
InChIInChI=1S/C19H16O3/c1-2-22-18-7-5-14-9-13(3-4-16(14)11-18)15-6-8-19(21)17(10-15)12-20/h3-12,21H,2H2,1H3
InChIKeyNGGYFDMPLTXQCS-UHFFFAOYSA-N
MW292.33 g/mol
LogP4.42
Rot. Bonds4

About 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde

5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde (PubChem CID 122358652) has the molecular formula C19H16O3 and a molecular weight of 292.33 g/mol. Its IUPAC name is 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde.

Molecular Properties

Compound Name5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde
PubChem CID122358652
Molecular FormulaC19H16O3
Molecular Weight292.33 g/mol
Exact Mass292.11
IUPAC Name5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde
SMILESCCOc1ccc2cc(-c3ccc(O)c(C=O)c3)ccc2c1
InChIInChI=1S/C19H16O3/c1-2-22-18-7-5-14-9-13(3-4-16(14)11-18)15-6-8-19(21)17(10-15)12-20/h3-12,21H,2H2,1H3
InChIKeyNGGYFDMPLTXQCS-UHFFFAOYSA-N
XLogP4.42
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 54.42
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

2-(4-ethoxyphenyl)-6-prop-2-enoxynaphthalene
CID 139863903
7-ethoxynaphthalene-1-carbaldehyde
CID 123261144
2-bromo-6-phenylnaphthalene;2-hydroxy-5-phenylbenzaldehyde
CID 159798770
(4-ethoxy-2-formylphenyl)boronic acid
CID 52987974
2,6-diethoxyanthracene
CID 12651989
5-(4-ethoxyphenyl)-2-hydroxy-3-nitrobenzaldehyde
CID 162352490
2-hydroxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]benzaldehyde
CID 15189859
2-ethyl-4-(6-methoxynaphthalen-2-yl)phenol
CID 57242092
4,5-diethoxy-2-hydroxybenzaldehyde
CID 22039093
3-hydroxy-6-methoxynaphthalene-2-carbaldehyde
CID 130034455
5-(2-fluoro-5-methoxyphenyl)-2-hydroxybenzaldehyde
CID 53220437
7-ethoxy-2-oxo-1H-quinoline-3-carbaldehyde
CID 765517

Frequently Asked Questions

What is the IUPAC name of 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde?
The IUPAC name of 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde (CID 122358652) is 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde.
What is the SMILES notation for 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde?
The canonical SMILES for 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde is CCOc1ccc2cc(-c3ccc(O)c(C=O)c3)ccc2c1.
What is the InChIKey of 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde?
The InChIKey is NGGYFDMPLTXQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O3/c1-2-22-18-7-5-14-9-13(3-4-16(14)11-18)15-6-8-19(21)17(10-15)12-20/h3-12,21H,2H2,1H3.
What are the key properties of 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde?
5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde has a molecular weight of 292.33 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-ethoxynaphthalen-2-yl)-2-hydroxybenzaldehyde is sourced from PubChem (CID 122358652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).