9-ethyl-10-naphthalen-2-ylanthracene

C26H20 — CID 143444762

IUPAC9-ethyl-10-naphthalen-2-ylanthracene
SMILESCCc1c2ccccc2c(-c2ccc3ccccc3c2)c2ccccc12
InChIInChI=1S/C26H20/c1-2-21-22-11-5-7-13-24(22)26(25-14-8-6-12-23(21)25)20-16-15-18-9-3-4-10-19(18)17-20/h3-17H,2H2,1H3
InChIKeyZXBGFLGDCIBUDW-UHFFFAOYSA-N
MW332.45 g/mol
LogP7.38
Rot. Bonds2

About 9-ethyl-10-naphthalen-2-ylanthracene

9-ethyl-10-naphthalen-2-ylanthracene (PubChem CID 143444762) has the molecular formula C26H20 and a molecular weight of 332.45 g/mol. Its IUPAC name is 9-ethyl-10-naphthalen-2-ylanthracene.

Molecular Properties

Compound Name9-ethyl-10-naphthalen-2-ylanthracene
PubChem CID143444762
Molecular FormulaC26H20
Molecular Weight332.45 g/mol
Exact Mass332.16
IUPAC Name9-ethyl-10-naphthalen-2-ylanthracene
SMILESCCc1c2ccccc2c(-c2ccc3ccccc3c2)c2ccccc12
InChIInChI=1S/C26H20/c1-2-21-22-11-5-7-13-24(22)26(25-14-8-6-12-23(21)25)20-16-15-18-9-3-4-10-19(18)17-20/h3-17H,2H2,1H3
InChIKeyZXBGFLGDCIBUDW-UHFFFAOYSA-N
XLogP7.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.45
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-10-naphthalen-2-ylanthracene?
The IUPAC name of 9-ethyl-10-naphthalen-2-ylanthracene (CID 143444762) is 9-ethyl-10-naphthalen-2-ylanthracene.
What is the SMILES notation for 9-ethyl-10-naphthalen-2-ylanthracene?
The canonical SMILES for 9-ethyl-10-naphthalen-2-ylanthracene is CCc1c2ccccc2c(-c2ccc3ccccc3c2)c2ccccc12.
What is the InChIKey of 9-ethyl-10-naphthalen-2-ylanthracene?
The InChIKey is ZXBGFLGDCIBUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20/c1-2-21-22-11-5-7-13-24(22)26(25-14-8-6-12-23(21)25)20-16-15-18-9-3-4-10-19(18)17-20/h3-17H,2H2,1H3.
What are the key properties of 9-ethyl-10-naphthalen-2-ylanthracene?
9-ethyl-10-naphthalen-2-ylanthracene has a molecular weight of 332.45 g/mol, XLogP of 7.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-10-naphthalen-2-ylanthracene is sourced from PubChem (CID 143444762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).