Ethanone,1-(2,6-dimethylphenyl)- supplier

Name
2,6-DIMETHYLACETOPHENONE
EINECS 218-400-0
CAS No. 2142-76-9
Article Data21
CAS DataBase
Density 0.965 g/cm³
Solubility
Melting Point 24℃ (ethanol )
Formula C₁₀H₁₂O
Boiling Point 225.1 °C at 760 mmHg
Molecular Weight 148.205
Flash Point 85.6 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2',6'-Dimethylacetophenone;
PSA 17.07000
LogP 2.50600

Ethanone,1-(2,6-dimethylphenyl)- Specification

The Ethanone,1-(2,6-dimethylphenyl)-, with the CAS registry number of 2142-76-9, is also known as 2',6'-Dimethylacetophenone. It belongs to the product category of Aromatic Acetophenones & Derivatives (substituted). Its EINECS registry number is 218-400-0. This chemical's molecular formula is C₁₀H₁₂O and molecular weight is 148.2. What's more, its systematic name is 1-(2,6-Dimethylphenyl)ethanone.You should avoid contact it with skin and eyes.

Physical properties about the Ethanone,1-(2,6-dimethylphenyl)- are: (1)ACD/LogP: 2.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.59; (4)ACD/LogD (pH 7.4): 2.59; (5)ACD/BCF (pH 5.5): 54.28; (6)ACD/BCF (pH 7.4): 54.28; (7)ACD/KOC (pH 5.5): 607.14; (8)ACD/KOC (pH 7.4): 607.14; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.51; (14)Molar Refractivity: 45.93 cm³; (15)Molar Volume: 153.5 cm³; (16)Surface Tension: 32.9 dyne/cm; (17)Density: 0.965 g/cm³; (18)Flash Point: 85.6 °C; (19)Enthalpy of Vaporization: 46.17 kJ/mol; (20)Boiling Point: 225.1 °C at 760 mmHg; (21)Vapour Pressure: 0.0878 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1c(cccc1C)C)C
(2) InChI: InChI=1/C10H12O/c1-7-5-4-6-8(2)10(7)9(3)11/h4-6H,1-3H3
(3) InChIKey: DDXBCZCBZGPSHD-UHFFFAOYAD

Product Name

2,6-DIMETHYLACETOPHENONE

Ethanone,1-(2,6-dimethylphenyl)- Specification

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