9,10-diphenyl-1,4-dihydroanthracene

C26H20 — CID 134158866

IUPAC9,10-diphenyl-1,4-dihydroanthracene
SMILESC1=CCc2c(c(-c3ccccc3)c3ccccc3c2-c2ccccc2)C1
InChIInChI=1S/C26H20/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25/h1-15,17H,16,18H2
InChIKeySKSFHHFTWZNLSV-UHFFFAOYSA-N
MW332.45 g/mol
LogP6.83
Rot. Bonds2

About 9,10-diphenyl-1,4-dihydroanthracene

9,10-diphenyl-1,4-dihydroanthracene (PubChem CID 134158866) has the molecular formula C26H20 and a molecular weight of 332.45 g/mol. Its IUPAC name is 9,10-diphenyl-1,4-dihydroanthracene.

Molecular Properties

Compound Name9,10-diphenyl-1,4-dihydroanthracene
PubChem CID134158866
Molecular FormulaC26H20
Molecular Weight332.45 g/mol
Exact Mass332.16
IUPAC Name9,10-diphenyl-1,4-dihydroanthracene
SMILESC1=CCc2c(c(-c3ccccc3)c3ccccc3c2-c2ccccc2)C1
InChIInChI=1S/C26H20/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25/h1-15,17H,16,18H2
InChIKeySKSFHHFTWZNLSV-UHFFFAOYSA-N
XLogP6.83
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 ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9,10-diphenyl-1,4-dihydroanthracene?
The IUPAC name of 9,10-diphenyl-1,4-dihydroanthracene (CID 134158866) is 9,10-diphenyl-1,4-dihydroanthracene.
What is the SMILES notation for 9,10-diphenyl-1,4-dihydroanthracene?
The canonical SMILES for 9,10-diphenyl-1,4-dihydroanthracene is C1=CCc2c(c(-c3ccccc3)c3ccccc3c2-c2ccccc2)C1.
What is the InChIKey of 9,10-diphenyl-1,4-dihydroanthracene?
The InChIKey is SKSFHHFTWZNLSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25/h1-15,17H,16,18H2.
What are the key properties of 9,10-diphenyl-1,4-dihydroanthracene?
9,10-diphenyl-1,4-dihydroanthracene has a molecular weight of 332.45 g/mol, XLogP of 6.83, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-diphenyl-1,4-dihydroanthracene is sourced from PubChem (CID 134158866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).