9bH-phenalene-1,2-dicarbaldehyde

C15H10O2 — CID 10466110

IUPAC9bH-phenalene-1,2-dicarbaldehyde
SMILESO=CC1=CC2=CC=CC3=CC=CC(=C1C=O)C32
InChIInChI=1S/C15H10O2/c16-8-12-7-11-5-1-3-10-4-2-6-13(15(10)11)14(12)9-17/h1-9,15H
InChIKeyVAMRJSXVUHYUFA-UHFFFAOYSA-N
MW222.24 g/mol
LogP2.23
Rot. Bonds2

About 9bH-phenalene-1,2-dicarbaldehyde

9bH-phenalene-1,2-dicarbaldehyde (PubChem CID 10466110) has the molecular formula C15H10O2 and a molecular weight of 222.24 g/mol. Its IUPAC name is 9bH-phenalene-1,2-dicarbaldehyde.

Molecular Properties

Compound Name9bH-phenalene-1,2-dicarbaldehyde
PubChem CID10466110
Molecular FormulaC15H10O2
Molecular Weight222.24 g/mol
Exact Mass222.07
IUPAC Name9bH-phenalene-1,2-dicarbaldehyde
SMILESO=CC1=CC2=CC=CC3=CC=CC(=C1C=O)C32
InChIInChI=1S/C15H10O2/c16-8-12-7-11-5-1-3-10-4-2-6-13(15(10)11)14(12)9-17/h1-9,15H
InChIKeyVAMRJSXVUHYUFA-UHFFFAOYSA-N
XLogP2.23
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 52.23
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

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CID 117275570
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9bH-perimidin-2-amine;hydrobromide
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7,9-diphenyl-9cH-cyclopenta[a]acenaphthylene
CID 14023518
10b,10c-dihydropyrene;ethane
CID 123567787
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CID 13495838
7,7a-dihydro-1-benzothiophene-3-carbaldehyde
CID 163944141
2-iodo-10b,10c-dihydropyrene
CID 138626052
10-propan-2-yl-4,10c-dihydropyrene
CID 169059563
N-[1-(8-methyl-8,8a-dihydronaphthalen-1-yl)ethyl]ethanimine
CID 91595441
(7aR)-1,7a-dihydro-2,1,3-benzoxadiazole-7-carbaldehyde
CID 163761639

Frequently Asked Questions

What is the IUPAC name of 9bH-phenalene-1,2-dicarbaldehyde?
The IUPAC name of 9bH-phenalene-1,2-dicarbaldehyde (CID 10466110) is 9bH-phenalene-1,2-dicarbaldehyde.
What is the SMILES notation for 9bH-phenalene-1,2-dicarbaldehyde?
The canonical SMILES for 9bH-phenalene-1,2-dicarbaldehyde is O=CC1=CC2=CC=CC3=CC=CC(=C1C=O)C32.
What is the InChIKey of 9bH-phenalene-1,2-dicarbaldehyde?
The InChIKey is VAMRJSXVUHYUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O2/c16-8-12-7-11-5-1-3-10-4-2-6-13(15(10)11)14(12)9-17/h1-9,15H.
What are the key properties of 9bH-phenalene-1,2-dicarbaldehyde?
9bH-phenalene-1,2-dicarbaldehyde has a molecular weight of 222.24 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9bH-phenalene-1,2-dicarbaldehyde is sourced from PubChem (CID 10466110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).