-
Name
2,7-DIACETYLFLUORENE
- EINECS
- CAS No. 961-27-3
- Article Data17
- CAS DataBase
- Density 1.183 g/cm3
- Solubility
- Melting Point 173 °C
- Formula C17H14O2
- Boiling Point 459.6 °C at 760 mmHg
- Molecular Weight 250.297
- Flash Point 171 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
-
Hazard Symbols
Xi
- Synonyms Fluorene,2,7-diacetyl- (6CI,7CI,8CI);2,7-Diacetyl-9H-fluorene;2,7-Diacetylfluorene;NSC 137171;
- PSA 34.14000
- LogP 3.66300
Ethanone,1,1'-(9H-fluorene-2,7-diyl)bis- Specification
The Ethanone,1,1'-(9H-fluorene-2,7-diyl)bis- is an organic compound with the formula C17H14O2. The IUPAC name of this chemical is 1-(7-acetyl-9H-fluoren-2-yl)ethanone. With the CAS registry number 961-27-3, it is also named as 1,1'-(9H-Fluorene-2,7-diyl)diethanone. The product's categories are Fluorenes; Fluorenes & Fluorenones.
The other characteristics of Ethanone,1,1'-(9H-fluorene-2,7-diyl)bis- can be summarized as: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 34.14 Å2; (7)Index of Refraction: 1.615; (8)Molar Refractivity: 73.85 cm3; (9)Molar Volume: 211.3 cm3; (10)Polarizability: 29.27×10-24 cm3; (11)Surface Tension: 48.2 dyne/cm; (12)Density: 1.183 g/cm3; (13)Flash Point: 171 °C; (14)Enthalpy of Vaporization: 72.01 kJ/mol; (15)Boiling Point: 459.6 °C at 760 mmHg; (16)Vapour Pressure: 1.25E-08 mmHg at 25°C; (17)Rotatable Bond Count: 2; (18)Tautomer Count: 3; (19)Exact Mass: 250.09938; (20)MonoIsotopic Mass: 250.09938; (21)Topological Polar Surface Area: 34.1; (22)Heavy Atom Count: 19; (23)Complexity: 351.
People can use the following data to convert to the molecule structure.
1. SMILES:O=C(c3ccc2c1ccc(cc1Cc2c3)C(=O)C)C
2. InChI:InChI=1/C17H14O2/c1-10(18)12-3-5-16-14(7-12)9-15-8-13(11(2)19)4-6-17(15)16/h3-8H,9H2,1-2H3
3. InChIKey:RIRYGERFWHUZBT-UHFFFAOYAL
4. Std. InChI:InChI=1S/C17H14O2/c1-10(18)12-3-5-16-14(7-12)9-15-8-13(11(2)19)4-6-17(15)16/h3-8H,9H2,1-2H3
5. Std. InChIKey:RIRYGERFWHUZBT-UHFFFAOYSA-N
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