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The Propanamide, 2-chloro-, with CAS registry number 27816-36-0, belongs to the following product categories: (1)Amides; (2)Carbonyl Compounds; (3)Organic Building Blocks. It has the systematic name of 2-chloropropanamide. This chemical is a kind of white to beige crystalline powder. When use this chemical, please avoid contact with skin and eyes. What's more, its EINECS is 248-671-0.
Physical properties of Propanamide, 2-chloro-: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 19.506; (5)ACD/KOC (pH 7.4): 19.506; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 43.09 Å2; (10)Index of Refraction: 1.449; (11)Molar Refractivity: 24.32 cm3; (12)Molar Volume: 90.614 cm3; (13)Polarizability: 9.641×10-24cm3; (14)Surface Tension: 35.66 dyne/cm; (15)Density: 1.187 g/cm3; (16)Flash Point: 98.855 °C; (17)Enthalpy of Vaporization: 47.675 kJ/mol; (18)Boiling Point: 239.845 °C at 760 mmHg; (19)Vapour Pressure: 0.039 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C(=O)N)Cl
(2)InChI: InChI=1/C3H6ClNO/c1-2(4)3(5)6/h2H,1H3,(H2,5,6)
(3)InChIKey: OEZPDHRXGCLGKB-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C3H6ClNO/c1-2(4)3(5)6/h2H,1H3,(H2,5,6)
(5)Std. InChIKey: OEZPDHRXGCLGKB-UHFFFAOYSA-N