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| CAS No.: | 58371-98-5 |
|---|---|
| Name: | 3,5-dichloropentan-2-one |
| Article Data: | 17 |
| Molecular Structure: | |
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| Formula: | C5H8Cl2O |
| Molecular Weight: | 155.024 |
| Synonyms: | 3,5-Dichloro-2-pentanone; |
| EINECS: | 261-227-0 |
| Density: | 1.18 g/cm3 |
| Boiling Point: | 208.1 °C at 760 mmHg |
| Flash Point: | 82.3 °C |
| PSA: | 17.07000 |
| LogP: | 1.81170 |
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- Total:34 Page 1 of 1 1
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Specification
The 2-Pentanone,3,5-dichloro- is an organic compound with the formula C5H8Cl2O. With the CAS registry number 58371-98-5, the IUPAC name of this chemical is 3,5-dichloropentan-2-one.
Physical properties about 2-Pentanone,3,5-dichloro- are: (1)ACD/LogP: 1.51; (2)ACD/LogD (pH 5.5): 1.51; (3)ACD/LogD (pH 7.4): 1.51; (4)ACD/BCF (pH 5.5): 8.33; (5)ACD/BCF (pH 7.4): 8.33; (6)ACD/KOC (pH 5.5): 158.74; (7)ACD/KOC (pH 7.4): 158.74; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 17.07 Å2; (11)Index of Refraction: 1.444; (12)Molar Refractivity: 34.89 cm3; (13)Molar Volume: 131.3 cm3; (14)Polarizability: 13.83×10-24cm3; (15)Surface Tension: 31.2 dyne/cm; (16)Density: 1.18 g/cm3; (17)Flash Point: 82.3 °C; (18)Enthalpy of Vaporization: 44.44 kJ/mol; (19)Boiling Point: 208.1 °C at 760 mmHg; (20)Vapour Pressure: 0.217 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCCC(Cl)C(=O)C
(2)InChI: InChI=1/C5H8Cl2O/c1-4(8)5(7)2-3-6/h5H,2-3H2,1H3
(3)InChIKey: NOSBOKVYSXXKFL-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C5H8Cl2O/c1-4(8)5(7)2-3-6/h5H,2-3H2,1H3
(5)Std. InChIKey: NOSBOKVYSXXKFL-UHFFFAOYSA-N