3-tert-Butyl-9,10-di(naphth-2-yl)anthracene supplier

Name
2-TERTBUTYL-9,10-DI(2-NAPHTHYL)ANTHRACENE
EINECS
CAS No. 274905-73-6
Article Data5
CAS DataBase
Density 1.15 g/cm³
Solubility
Melting Point
Formula C₃₈H₃₀
Boiling Point 624.807 °C at 760 mmHg
Molecular Weight 486.656
Flash Point 335.625 °C
Transport Information
Appearance
Safety
Risk Codes 53
Molecular Structure
Hazard Symbols
Synonyms 2-tert-Butyl-9,10-bis(2-naphthyl)anthracene;2-tert-Butyl-9,10-di(2-naphthyl)anthracene;9,10-Di(naphthalen-2-yl)-2-tert-butylanthracene;TBADN;
PSA 0.00000
LogP 10.93090

3-tert-Butyl-9,10-di(naphth-2-yl)anthracene Specification

The 3-tert-Butyl-9,10-di(naphth-2-yl)anthracene with the CAS number 274905-73-6 is also called Anthracene,2-(1,1-dimethylethyl)-9,10-di-2-naphthalenyl-. The systematic name is 2-tert-butyl-9,10-di(naphthalen-2-yl)anthracene. Its molecular formula is C₃₈H₃₀. The product category is Electronic Chemicals.

The properties of the 3-tert-Butyl-9,10-di(naphth-2-yl)anthracene are: (1)ACD/LogP: 12.65; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 12; (4)ACD/LogD (pH 7.4): 12; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.709; (14)Molar Refractivity: 165.194 cm³; (15)Molar Volume: 423.154 cm³; (16)Polarizability: 65.488×10^-24cm³; (17)Surface Tension: 48.616 dyne/cm; (18)Enthalpy of Vaporization: 89.132 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)c4ccc5c(c1ccccc1c(c2cc3ccccc3cc2)c5c4)c6cc7ccccc7cc6
(2)InChI: InChI=1/C38H30/c1-38(2,3)31-20-21-34-35(24-31)37(30-19-17-26-11-5-7-13-28(26)23-30)33-15-9-8-14-32(33)36(34)29-18-16-25-10-4-6-12-27(25)22-29/h4-24H,1-3H3
(3)InChIKey: OBAJPWYDYFEBTF-UHFFFAOYAJ

Product Name

2-TERTBUTYL-9,10-DI(2-NAPHTHYL)ANTHRACENE

3-tert-Butyl-9,10-di(naphth-2-yl)anthracene Specification

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