9,10-Di(2-naphthyl)anthracene

Details:

1.Introduction of 122648-99-1

9,10-Di(2-naphthyl)anthracene has CAS registry number of 122648-99-1. Its synonyms are 9,10-di-naphthalen-2-yl-anthracene; 9,10-di-(2-naphthyl)anthracene; 9,10-bis-(2-naphthyl)-anthracene; adn; 9,10-di-beta-naphthylanthracene; 9,10-di-(2-naphthyl); ADN, 9,10-di(2-naphthyl)anthracene; 9,10-Di(2-naphthyl)anthracene (AND). It has molecular formula of C34H22 and molecular weight of 430.53848.

2.Properties of 122648-99-1

ACD/LogP: 10.656
# of Rule of 5 Violations: 1
ACD/LogD (pH 5.5): 10.66
ACD/LogD (pH 7.4): 10.66
ACD/BCF (pH 5.5): 1000000.00
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/KOC (pH 7.4): 10000000.00
#Freely Rotating Bonds: 2
Index of Refraction: 1.761
Molar Refractivity: 146.807 cm³
Molar Volume: 356.466 cm³
Polarizability: 58.199 10-24cm³
Surface Tension: 54.6759986877441 dyne/cm
Density: 1.208 g/cm³
Flash Point: 314.818 °C
Enthalpy of Vaporization: 85.453 kJ/mol
Boiling Point: 595.39 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 122648-99-1

(1)InChI: InChI=1S/C34H22/c1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-22H
(2)InChIKey: VIZUPBYFLORCRA-UHFFFAOYSA-N
(3)Canonical SMILES : C1=CC=C2C=C(C=CC2=C1)C3=C4C=CC=CC4=C(C5=CC=CC=C53)C6=CC7=CC=CC=C7C=C6

4.Safety Information of 122648-99-1

Risk Statements: 36/37/38
Safety Statements: 26-36/37/39