Product Name

  • Name

    N-(6-Chloro-3-formyl-pyridin-2-yl)-2,2-dimethyl-propionamide

  • EINECS
  • CAS No. 127446-34-8
  • Article Data6
  • CAS DataBase
  • Density 1.274 g/cm3
  • Solubility
  • Melting Point 137-139℃
  • Formula C11H13ClN2O2
  • Boiling Point 428.644 °C at 760 mmHg
  • Molecular Weight 240.689
  • Flash Point 213.037 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 127446-34-8 (N-(6-Chloro-3-formyl-pyridin-2-yl)-2,2-dimethyl-propionamide)
  • Hazard Symbols
  • Synonyms N-(6-Chloro-3-formylpyridin-2-yl)-2,2-dimethylpropionamide;N-(6-Chloro-3-formyl-2-pyridinyl)-2,2-dimethylpropanamide;
  • PSA 59.06000
  • LogP 2.60510

N-(6-Chloro-3-formylpyridin-2-yl)pivalamide Specification

The N-(6-Chloro-3-formylpyridin-2-yl)pivalamide, with the CAS registry number 127446-34-8, is also known as N-(6-Chloro-3-formylpyridin-2-yl)-2,2-dimethylpropionamide. his chemical's molecular formula is C11H13ClN2O2 and molecular weight is 240.69. What's more, its systematic name is N-(6-Chloro-3-formyl-2-pyridinyl)-2,2-dimethylpropanamide.

Physical properties of N-(6-Chloro-3-formylpyridin-2-yl)pivalamide are: (1)ACD/LogP: 2.692; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.69; (4)ACD/LogD (pH 7.4): 2.69; (5)ACD/BCF (pH 5.5): 65.48; (6)ACD/BCF (pH 7.4): 65.48; (7)ACD/KOC (pH 5.5): 694.36; (8)ACD/KOC (pH 7.4): 694.36; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 59.06 Å2; (13)Index of Refraction: 1.594; (14)Molar Refractivity: 64.128 cm3; (15)Molar Volume: 188.925 cm3; (16)Polarizability: 25.422×10-24cm3; (17)Surface Tension: 49.27 dyne/cm; (18)Density: 1.274 g/cm3; (19)Flash Point: 213.037 °C; (20)Enthalpy of Vaporization: 68.381 kJ/mol; (21)Boiling Point: 428.644 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ccc(Cl)nc1NC(=O)C(C)(C)C
(2)Std. InChI: InChI=1S/C11H13ClN2O2/c1-11(2,3)10(16)14-9-7(6-15)4-5-8(12)13-9/h4-6H,1-3H3,(H,13,14,16)
(3)Std. InChIKey: QTIICTFBNRXNRF-UHFFFAOYSA-N

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