2-Propanone,1-(4-chlorophenoxy)- supplier

Name
1-(4-CHLOROPHENOXY)-2-PROPANONE
EINECS
CAS No. 18859-35-3
Article Data14
CAS DataBase
Density 1.187 g/cm³
Solubility
Melting Point
Formula C₉H₉ClO₂
Boiling Point 268.1 °C at 760 mmHg
Molecular Weight 184.622
Flash Point 114.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Propanone,(p-chlorophenoxy)- (7CI);2-Propanone, 1-(p-chlorophenoxy)- (8CI);(4-Chlorophenoxy)acetone;1-(4-Chlorophenoxy)-2-propanone;NSC 45653;
PSA 26.30000
LogP 2.30780

2-Propanone,1-(4-chlorophenoxy)- Specification

The 2-Propanone,1-(4-chlorophenoxy)-, with the CAS registry number 18859-35-3, is also known as 1-(4-Chlorophenoxy)acetone. This chemical's molecular formula is C₉H₉ClO₂ and molecular weight is 184.62. What's more, both its IUPAC name and systematic name are the same which is called 1-(4-Chlorophenoxy)propan-2-one.

Physical properties about 2-Propanone,1-(4-chlorophenoxy)- are: (1) ACD/LogP: 1.73; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 2; (4) #H bond donors: 0; (5) #Freely Rotating Bonds: 3; (6) Polar Surface Area: 26.3 Å²; (7) Index of Refraction: 1.517; (8) Molar Refractivity: 47.12 cm³; (9) Molar Volume: 155.5 cm³; (10) Surface Tension: 37.3 dyne/cm; (11) Density: 1.187 g/cm³; (12) Flash Point: 114.2 °C; (13) Enthalpy of Vaporization: 50.62 kJ/mol; (14) Boiling Point: 268.1 °C at 760 mmHg; (15) Vapour Pressure: 0.00782 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc(OCC(=O)C)cc1
(2) InChI: InChI=1/C9H9ClO2/c1-7(11)6-12-9-4-2-8(10)3-5-9/h2-5H,6H2,1H3
(3) InChIKey: DFBZHQBJMFLYJF-UHFFFAOYAK

Product Name

1-(4-CHLOROPHENOXY)-2-PROPANONE

2-Propanone,1-(4-chlorophenoxy)- Specification

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