CAS No.613-80-9,2,2'-DINAPHTHYL ETHER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	613-80-9
Name:	2,2'-DINAPHTHYL ETHER
Article Data:	30

Formula:	C₂₀H₁₄O
Molecular Weight:	270.331
Synonyms:	2-Naphthylether (6CI,7CI,8CI);2,2'-Dinaphthyl ether;Di-b-naphthyl ether;
EINECS:	210-356-0
Density:	1.184 g/cm³
Melting Point:	105 °C
Boiling Point:	449.9 °C at 760 mmHg
Flash Point:	226.1 °C
Safety:	22-24/25
PSA:	9.23000
LogP:	5.78530

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Specification

The CAS register number of Naphthalene,2,2'-oxybis- is 613-80-9. It also can be called as Di-b-naphthyl ether and the systematic name about this chemical is 2,2'-oxydinaphthalene. The molecular formula about this chemical is C₂₀H₁₄O and the molecular weight is 270.32. When you are using this chemical, do not breathe dust and avoid contact with skin and eyes. It is stable under normal temperature and pressure. If you want to store it, you should keep the container tightly sealed in dry, cool places.

Physical properties about Naphthalene,2,2'-oxybis- are: (1)ACD/LogP: 6.67; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.67; (4)ACD/LogD (pH 7.4): 6.67; (5)ACD/BCF (pH 5.5): 69224.45; (6)ACD/BCF (pH 7.4): 69224.45; (7)ACD/KOC (pH 5.5): 101446.83; (8)ACD/KOC (pH 7.4): 101446.83; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23 Å²; (12)Index of Refraction: 1.701; (13)Molar Refractivity: 88.38 cm³; (14)Molar Volume: 228.2 cm³; (15)Polarizability: 35.03x10^-24cm³; (16)Surface Tension: 49.7 dyne/cm; (17)Density: 1.184 g/cm³; (18)Flash Point: 226.1 °C; (19)Enthalpy of Vaporization: 68.15 kJ/mol; (20)Boiling Point: 449.9 °C at 760 mmHg; (21)Vapour Pressure: 7.3E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c2cc1ccccc1cc2)c4ccc3c(cccc3)c4
(2)InChI: InChI=1/C20H14O/c1-3-7-17-13-19(11-9-15(17)5-1)21-20-12-10-16-6-2-4-8-18(16)14-20/h1-14H
(3)InChIKey: DZRLNYVDCIYXPG-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C20H14O/c1-3-7-17-13-19(11-9-15(17)5-1)21-20-12-10-16-6-2-4-8-18(16)14-20/h1-14H
(5)Std. InChIKey: DZRLNYVDCIYXPG-UHFFFAOYSA-N