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- Name Acetamide,2-chloro-N-2-propen-1-yl-
- EINECSN/A
- CAS No. 13269-97-1
- Density1.081g/cm3
- PSA29.10000
- LogP0.91830
- SolubilityN/A
- Melting PointN/A
- FormulaC5H8ClNO
- Boiling Point270.3 °C at 760 mmHg
- Molecular Weight133.578
- Flash Point117.3 °C
- Transport InformationN/A
- AppearanceN/A
- Safety
- Risk CodesN/A
- Molecular Structure
- Hazard Symbols
Xi - SynonymsXi
- Article Data17
Acetamide,2-chloro-N-2-propen-1-yl- Specification
The Acetamide,2-chloro-N-2-propen-1-yl-, with CAS registry number 13269-97-1, has the systematic name of 2-chloro-N-(prop-2-en-1-yl)acetamide. Besides this, it is also called N-(Chloroacetyl)allylamine. And the chemical formula of this chemical is C5H8ClNO.
Physical properties of Acetamide,2-chloro-N-2-propen-1-yl-: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.04; (4)ACD/LogD (pH 7.4): 0.04; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 25.09; (8)ACD/KOC (pH 7.4): 25.09; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.453; (14)Molar Refractivity: 33.41 cm3; (15)Molar Volume: 123.4 cm3; (16)Polarizability: 13.24×10-24cm3; (17)Surface Tension: 31 dyne/cm; (18)Density: 1.081 g/cm3; (19)Flash Point: 117.3 °C; (20)Enthalpy of Vaporization: 50.85 kJ/mol; (21)Boiling Point: 270.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00688 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCC(=O)NC\C=C
(2)InChI: InChI=1/C5H8ClNO/c1-2-3-7-5(8)4-6/h2H,1,3-4H2,(H,7,8)
(3)InChIKey: AZOOMRDAGOXGNJ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C5H8ClNO/c1-2-3-7-5(8)4-6/h2H,1,3-4H2,(H,7,8)
(5)Std. InChIKey: AZOOMRDAGOXGNJ-UHFFFAOYSA-N
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