Propanamide,N-ethyl-N-(3-methylphenyl)- supplier

Name
ALICATE
EINECS
CAS No. 179911-08-1
Density 1.004 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₇NO
Boiling Point 299.2 °C at 760 mmHg
Molecular Weight 191.27
Flash Point 128.6 °C
Transport Information
Appearance colourless to pale yellow non viscous liquid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Alicate;
PSA 20.31000
LogP 2.75790

Propanamide,N-ethyl-N-(3-methylphenyl)- Specification

The Propanamide,N-ethyl-N-(3-methylphenyl)-, with the CAS registry number 179911-08-1, is also known as Alicate. This chemical's molecular formula is C₁₂H₁₇NO and molecular weight is 191.27. What's more, its IUPAC name is N-ethyl-N-(3-methylphenyl)propanamide. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties of Propanamide,N-ethyl-N-(3-methylphenyl)- 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): 55.02; (6)ACD/BCF (pH 7.4): 55.02; (7)ACD/KOC (pH 5.5): 613; (8)ACD/KOC (pH 7.4): 613.01; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 59.31 cm³; (15)Molar Volume: 190.3 cm³; (16)Polarizability: 23.51×10^-24cm³; (17)Surface Tension: 37.6 dyne/cm; (18)Density: 1.004 g/cm³; (19)Flash Point: 128.6 °C; (20)Enthalpy of Vaporization: 53.92 kJ/mol; (21)Boiling Point: 299.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00121 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCC(=O)N(CC)c1cccc(c1)C
(2)Std. InChI: InChI=1S/C12H17NO/c1-4-12(14)13(5-2)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3
(3)Std. InChIKey: DSYVYGLBPDTBKH-UHFFFAOYSA-N

Product Name

ALICATE

Propanamide,N-ethyl-N-(3-methylphenyl)- Specification

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