2-Propanone,1-(2,3-dichlorophenyl)- supplier

Name
2,3-DICHLOROPHENYLACETONE
EINECS
CAS No. 102052-39-1
Article Data2
CAS DataBase
Density 1.27 g/cm³
Solubility
Melting Point
Formula C₉H₈Cl₂O
Boiling Point 271.3 °C at 760 mmHg
Molecular Weight 203.07
Flash Point 112.5 °C
Transport Information
Appearance Pale yellow liquid or low melting solid
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,3-Dichlorophenylacetone;1-(2,3-Dichlorophenyl)propan-2-one;
PSA 17.07000
LogP 3.12490

2-Propanone,1-(2,3-dichlorophenyl)- Specification

The 2-Propanone,1-(2,3-dichlorophenyl)-, with the CAS registry number 102052-39-1, is also known as 2,3-Dichlorophenylacetone. This chemical's molecular formula is C₉H₈Cl₂O and molecular weight is 203.07. What's more, its systematic name is 1-(2,3-Dichlorophenyl)propan-2-one. The product should be sealed and stored in containers which are placed in cool, ventilated and dry places. When using it, you need avoid contact with skin and eyes.

Physical properties of 2-Propanone,1-(2,3-dichlorophenyl)- are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.5; (4)ACD/LogD (pH 7.4): 2.5; (5)ACD/BCF (pH 5.5): 47.1; (6)ACD/BCF (pH 7.4): 47.1; (7)ACD/KOC (pH 5.5): 548.5; (8)ACD/KOC (pH 7.4): 548.5; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.541; (14)Molar Refractivity: 50.25 cm³; (15)Molar Volume: 159.7 cm³; (16)Polarizability: 19.92×10^-24cm³; (17)Surface Tension: 39.4 dyne/cm; (18)Density: 1.27 g/cm³; (19)Flash Point: 112.5 °C; (20)Enthalpy of Vaporization: 50.96 kJ/mol; (21)Boiling Point: 271.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00649 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)CC1=C(C(=CC=C1)Cl)Cl
(2)InChI: InChI=1S/C9H8Cl2O/c1-6(12)5-7-3-2-4-8(10)9(7)11/h2-4H,5H2,1H3
(3)InChIKey: XDICTTCDZLICHJ-UHFFFAOYSA-N

Product Name

2,3-DICHLOROPHENYLACETONE

2-Propanone,1-(2,3-dichlorophenyl)- Specification

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