naphthalene-2,6-dicarbaldehyde

C24H16O4 — CID 159038637

IUPACnaphthalene-2,6-dicarbaldehyde
SMILESO=Cc1ccc2cc(C=O)ccc2c1.O=Cc1ccc2cc(C=O)ccc2c1
InChIInChI=1S/2C12H8O2/c2*13-7-9-1-3-11-6-10(8-14)2-4-12(11)5-9/h2*1-8H
InChIKeyJVTOEOKOYHVCJW-UHFFFAOYSA-N
MW368.39 g/mol
LogP4.93
Rot. Bonds4

About naphthalene-2,6-dicarbaldehyde

naphthalene-2,6-dicarbaldehyde (PubChem CID 159038637) has the molecular formula C24H16O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is naphthalene-2,6-dicarbaldehyde.

Molecular Properties

Compound Namenaphthalene-2,6-dicarbaldehyde
PubChem CID159038637
Molecular FormulaC24H16O4
Molecular Weight368.39 g/mol
Exact Mass368.10
IUPAC Namenaphthalene-2,6-dicarbaldehyde
SMILESO=Cc1ccc2cc(C=O)ccc2c1.O=Cc1ccc2cc(C=O)ccc2c1
InChIInChI=1S/2C12H8O2/c2*13-7-9-1-3-11-6-10(8-14)2-4-12(11)5-9/h2*1-8H
InChIKeyJVTOEOKOYHVCJW-UHFFFAOYSA-N
XLogP4.93
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-methylnaphthalene-2-carbaldehyde
CID 6452268
N-methylmethanamine;naphthalene-2-carbaldehyde
CID 174771308
6-methylanthracene-2-carbaldehyde
CID 156805593
6-[(6-formylnaphthalen-2-yl)-dimethylsilyl]naphthalene-2-carbaldehyde
CID 166514383
6-(4-phenylphenyl)naphthalene-2-carbaldehyde
CID 59801235
5,8-dihydroanthracene-2-carbaldehyde
CID 87664562
ethanamine;naphthalene-2-carbaldehyde
CID 143882987
6-(difluoromethoxy)naphthalene-2-carbaldehyde
CID 118848493
1,4-dioxane;6-hydroxynaphthalene-2-carbaldehyde
CID 88868066
2,3-dihydro-1,4-benzodioxine;naphthalene-2,6-dicarbaldehyde
CID 87827068
hexahelicene-2,15-dicarbaldehyde
CID 10667716
6-benzoylnaphthalene-2-carbaldehyde
CID 160521224

Frequently Asked Questions

What is the IUPAC name of naphthalene-2,6-dicarbaldehyde?
The IUPAC name of naphthalene-2,6-dicarbaldehyde (CID 159038637) is naphthalene-2,6-dicarbaldehyde.
What is the SMILES notation for naphthalene-2,6-dicarbaldehyde?
The canonical SMILES for naphthalene-2,6-dicarbaldehyde is O=Cc1ccc2cc(C=O)ccc2c1.O=Cc1ccc2cc(C=O)ccc2c1.
What is the InChIKey of naphthalene-2,6-dicarbaldehyde?
The InChIKey is JVTOEOKOYHVCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H8O2/c2*13-7-9-1-3-11-6-10(8-14)2-4-12(11)5-9/h2*1-8H.
What are the key properties of naphthalene-2,6-dicarbaldehyde?
naphthalene-2,6-dicarbaldehyde has a molecular weight of 368.39 g/mol, XLogP of 4.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalene-2,6-dicarbaldehyde is sourced from PubChem (CID 159038637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).