-
Name
1,2,3,4,4a,9a-Hexahydro-1,4-methanoanthracene-9,10-dione
- EINECS
- CAS No. 24402-98-0
- Density 1.257 g/cm3
- Solubility
- Melting Point
- Formula C15H14O2
- Boiling Point 399.7 °C at 760 mmHg
- Molecular Weight 226.275
- Flash Point 149.7 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1,2,3,4,4a,9a-Hexahydro-1,4-methanoanthracene-9,10-dione
- PSA 34.14000
- LogP 2.72790
1,4-Methanoanthracene-9,10-dione,1,2,3,4,4a,9a-hexahydro- Specification
The 1,4-Methanoanthracene-9,10-dione,1,2,3,4,4a,9a-hexahydro- is an organic compound with the formula C15H14O2. The systematic name of this chemical is 1,2,3,4,4a,9a-hexahydro-1,4-methanoanthracene-9,10-dione. With the CAS registry number 24402-98-0, it is also named as Tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8-triene-3,10-dione.
Physical properties about 1,4-Methanoanthracene-9,10-dione,1,2,3,4,4a,9a-hexahydro- are: (1)ACD/LogP: 2.94; (2)ACD/LogD (pH 5.5): 2.94; (3)ACD/LogD (pH 7.4): 2.94; (4)ACD/BCF (pH 5.5): 101.22; (5)ACD/BCF (pH 7.4): 101.22; (6)ACD/KOC (pH 5.5): 948.37; (7)ACD/KOC (pH 7.4): 948.37; (8)#H bond acceptors: 2; (9)Polar Surface Area: 34.14 Å2; (10)Index of Refraction: 1.61; (11)Molar Refractivity: 62.46 cm3; (12)Molar Volume: 179.9 cm3; (13)Polarizability: 24.76×10-24cm3; (14)Surface Tension: 48.9 dyne/cm; (15)Density: 1.257 g/cm3; (16)Flash Point: 149.7 °C; (17)Enthalpy of Vaporization: 65.05 kJ/mol; (18)Boiling Point: 399.7 °C at 760 mmHg; (19)Vapour Pressure: 1.34E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1c4c(C(=O)C2C1C3CCC2C3)cccc4
(2)InChI: InChI=1/C15H14O2/c16-14-10-3-1-2-4-11(10)15(17)13-9-6-5-8(7-9)12(13)14/h1-4,8-9,12-13H,5-7H2
(3)InChIKey: CSZUOCIWGJGKHZ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C15H14O2/c16-14-10-3-1-2-4-11(10)15(17)13-9-6-5-8(7-9)12(13)14/h1-4,8-9,12-13H,5-7H2
(5)Std. InChIKey: CSZUOCIWGJGKHZ-UHFFFAOYSA-N
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