9,10-diphenylanthracene

• ChemBase ID: 108021
• Molecular Formular: C26H18
• Molecular Mass: 330.42112
• Monoisotopic Mass: 330.14085058
• SMILES: c1ccc(cc1)c1c2ccccc2c(c2ccccc2)c2ccccc12
• Canonical SMILES: c1ccc2c(c1)c(c1ccccc1)c1c(c2c2ccccc2)cccc1
• InChI: InChI=1S/C26H18/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/h1-18H
• InChIKey: FCNCGHJSNVOIKE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 9,10-diphenylanthracene
• IUPAC Traditional name: 9,10-diphenylanthracene
• Synonyms: 9,10-Diphenylanthracene; 9,10-DIPHENYLANTHRACENE; 9,10-二苯基蒽

Database IDs

• CAS Number: 1499-10-1
• EC Number: 216-105-1
• MDL Number: MFCD00001253
• Beilstein Number: 1914010
• PubChem SID: 24869403; 24866782; 162094082; 24893609
• PubChem CID: 15159
• Chemspider ID: 14430
• Wikipedia Title: 9,10-Diphenylanthracene

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.24665
• LogD (pH = 7.4): 7.24665
• Log P: 7.24665
• Molar Refractivity: 109.2308 cm^3
• Polarizability: 48.098457 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: Yellow powder
• Melting Point: 245°C; 245-248 °C(lit.); 245-250 °C; 248-250 °C; 248-254°C
• Density: 1.22 g/cm^3

Safety Information

• German water hazard class: 3
• Safety Statements: R
• TSCA Listed: 是
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: ≥98.0% (HPLC); 97%; 98%; 99%
• Grade: analytical standard, for environmental analysis; purum
• Empirical Formula (Hill Notation): C26H18

DETAILS

MP Biomedicals - 05205768

MP Biomedicals Rare Chemical collection

Sigma Aldrich - D205001

Packaging
1, 5 g in glass bottle

Sigma Aldrich - 42785

Other Notes
Fluorescer used in chemiluminescence, e.g. with oxalates1