Acetamide,2-chloro-N-2-propen-1-yl- supplier

Name
N-(CHLOROACETYL)ALLYLAMINE
EINECS
CAS No. 13269-97-1
Article Data17
CAS DataBase
Density 1.081g/cm³
Solubility
Melting Point
Formula C₅H₈ClNO
Boiling Point 270.3 °C at 760 mmHg
Molecular Weight 133.578
Flash Point 117.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms N-Allylchloroacetamide;N-Allyl-2-chloroacetamide;Acetamide,2-chloro-N-2-propenyl- (9CI);Acetamide, N-allyl-2-chloro- (6CI,7CI,8CI);NSC 165656;a-Chloro-N-allylacetamide;
PSA 29.10000
LogP 0.91830

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

Product Name

N-(CHLOROACETYL)ALLYLAMINE

Acetamide,2-chloro-N-2-propen-1-yl- Specification

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