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-
Name
CB 13
- EINECS
- CAS No. 432047-72-8
- Article Data3
- CAS DataBase
- Density 1.131 g/cm3
- Solubility
- Melting Point
- Formula C26H24O2
- Boiling Point 559.78 °C at 760 mmHg
- Molecular Weight 368.47
- Flash Point 235.119 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms CB 13;
- PSA 26.30000
- LogP 6.79300
1-Naphthalenyl[4-(pentyloxy)-1-naphthalenyl]methanone Specification
The 1-Naphthalenyl[4-(pentyloxy)-1-naphthalenyl]methanone is an organic compound with the formula C26H24O2. The systematic name of this chemical is naphthalen-1-yl[4-(pentyloxy)naphthalen-1-yl]methanone. With the CAS registry number 432047-72-8, it is also named as Methanone, 1-naphthalenyl[4-(pentyloxy)-1-naphthalenyl]-.
Physical properties about 1-Naphthalenyl[4-(pentyloxy)-1-naphthalenyl]methanone are: (1)ACD/LogP: 7.79; (2)# of Rule of 5 Violations: 1 ; (3)#H bond acceptors: 2; (4)#Freely Rotating Bonds: 7; (5)Polar Surface Area: 26.3 Å2; (6)Index of Refraction: 1.637; (7)Molar Refractivity: 116.941 cm3; (8)Molar Volume: 325.809 cm3; (9)Polarizability: 46.359×10-24cm3; (10)Surface Tension: 46.409 dyne/cm; (11)Density: 1.131 g/cm3; (12)Flash Point: 235.119 °C; (13)Enthalpy of Vaporization: 84.219 kJ/mol; (14)Boiling Point: 559.78 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2c1ccccc1c(OCCCCC)cc2)c4c3ccccc3ccc4
(2)InChI: InChI=1/C26H24O2/c1-2-3-8-18-28-25-17-16-24(21-13-6-7-14-22(21)25)26(27)23-15-9-11-19-10-4-5-12-20(19)23/h4-7,9-17H,2-3,8,18H2,1H3
(3)InChIKey: RSUMDJRTAFBISX-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C26H24O2/c1-2-3-8-18-28-25-17-16-24(21-13-6-7-14-22(21)25)26(27)23-15-9-11-19-10-4-5-12-20(19)23/h4-7,9-17H,2-3,8,18H2,1H3
(5)Std. InChIKey: RSUMDJRTAFBISX-UHFFFAOYSA-N
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