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Acetamide,N-(4-methoxy-2-methylphenyl)-

  • Name Acetamide,N-(4-methoxy-2-methylphenyl)-
  • EINECS250-724-8
  • CAS No. 31601-41-9
  • Density1.1 g/cm3
  • PSA38.33000
  • LogP2.03500
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC10H13NO2
  • Boiling Point336.6 °C at 760 mmHg
  • Molecular Weight179.219
  • Flash Point157.3 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 31601-41-9 (N-(4-methoxy-2-methylphenyl)acetamide)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data29

Acetamide,N-(4-methoxy-2-methylphenyl)- Specification

The Acetamide,N-(4-methoxy-2-methylphenyl)-, with the CAS registry number 31601-41-9 and EINECS registry number 250-724-8, has the systematic name of N-(4-methoxy-2-methylphenyl)acetamide. And the molecular formula of this chemical is C10H13NO2. In addition, it belongs to the product categories of Acids and Derivatives.

The physical properties of Acetamide,N-(4-methoxy-2-methylphenyl)- are as following: (1)ACD/LogP: 1.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.55; (4)ACD/LogD (pH 7.4): 1.55; (5)ACD/BCF (pH 5.5): 8.94; (6)ACD/BCF (pH 7.4): 8.94; (7)ACD/KOC (pH 5.5): 166.9; (8)ACD/KOC (pH 7.4): 166.95; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 52.02 cm3; (15)Molar Volume: 162.7 cm3; (16)Polarizability: 20.62×10-24cm3; (17)Surface Tension: 38.4 dyne/cm; (18)Density: 1.1 g/cm3; (19)Flash Point: 157.3 °C; (20)Enthalpy of Vaporization: 57.97 kJ/mol; (21)Boiling Point: 336.6 °C at 760 mmHg; (22)Vapour Pressure: 0.000111 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1c(cc(OC)cc1)C)C
(2)InChI: InChI=1/C10H13NO2/c1-7-6-9(13-3)4-5-10(7)11-8(2)12/h4-6H,1-3H3,(H,11,12)
(3)InChIKey: AYRUKGQCGNNMLA-UHFFFAOYAX

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