Basic information
- Name:
3-Pentanone,1,5-dichloro-
- Superlist Name:
- 1,5-Dichloropentan-3-one
- CAS No.:
3592-25-4
- Molecular Structure:
- Formula:
- C5H8Cl2O
- Molecular Weight:
- 155.02
- Synonyms:
- 1,5-Dichloro-3-pentanone;Bis(2-chloroethyl) ketone;
- Density:
- 1.183 g/cm3
- Boiling Point:
- 225 °C at 760 mmHg
- Flash Point:
- 90.6 °C
- Appearance:
- yellow to light brown liquid
- Hazard Symbols:
Xi
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The 3-Pentanone,1,5-dichloro- is an organic compound with the formula C5H8Cl2O. The systematic name of this chemical is 1,5-dichloropentan-3-one. With the CAS registry number 3592-25-4, it is also named as 1,5-Dichloro-3-pentanone. The product's category is API Intermediates. Besides, this chemical is yellow to light brown liquid.
The other characteristics of 3-Pentanone,1,5-dichloro- can be summarized as: (1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.04; (4)ACD/LogD (pH 7.4): 1.04; (5)ACD/BCF (pH 5.5): 3.63; (6)ACD/BCF (pH 7.4): 3.63; (7)ACD/KOC (pH 5.5): 87.66; (8)ACD/KOC (pH 7.4): 87.66; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 34.94 cm3; (15)Molar Volume: 130.9 cm3; (16)Polarizability: 13.85×10-24 cm3; (17)Surface Tension: 32.6 dyne/cm; (18)Density: 1.183 g/cm3; (19)Flash Point: 90.6 °C; (20)Enthalpy of Vaporization: 46.15 kJ/mol; (21)Boiling Point: 225 °C at 760 mmHg; (22)Vapour Pressure: 0.0884 mmHg at 25°C.
People can use the following data to convert to the molecule structure.
1. SMILES:ClCCC(=O)CCCl
2. InChI:InChI=1/C5H8Cl2O/c6-3-1-5(8)2-4-7/h1-4H2
3. InChIKey:LYJQMHVYFFZQGY-UHFFFAOYAY
4. Std. InChI:InChI=1S/C5H8Cl2O/c6-3-1-5(8)2-4-7/h1-4H2
5. Std. InChIKey:LYJQMHVYFFZQGY-UHFFFAOYSA-N
