CAS No.13916-39-7,2-CHLORO-N-PROPYLACETAMIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13916-39-7
Name:	2-CHLORO-N-PROPYLACETAMIDE
Article Data:	28

Formula:	C₅H₁₀ClNO
Molecular Weight:	135.594
Synonyms:	2-Chloro-N-propylacetamide;NSC 8268;a-Chloro-N-propylacetamide;
Density:	1.056g/cm³
Boiling Point:	260.1 °C at 760 mmHg
Flash Point:	111.1 °C
Appearance:	Colorless transparent liquid
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	29.10000
LogP:	1.14230

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Specification

The Acetamide,2-chloro-N-propyl-, with CAS registry number 13916-39-7, has the systematic name of 2-chloro-N-propylacetamide. Besides this, it is also called a-Chloro-N-propylacetamide. Its molecular weight is 135.59. And the chemical formula of this chemical is C₅H₁₀ClNO.

Physical properties of Acetamide,2-chloro-N-propyl-: (1)ACD/LogP: 0.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.25; (4)ACD/LogD (pH 7.4): 0.25; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 32.38; (8)ACD/KOC (pH 7.4): 32.38; (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: 1.437; (14)Molar Refractivity: 33.68 cm³; (15)Molar Volume: 128.3 cm³; (16)Polarizability: 13.35×10^-24cm³; (17)Surface Tension: 30.8 dyne/cm; (18)Density: 1.056 g/cm³; (19)Flash Point: 111.1 °C; (20)Enthalpy of Vaporization: 49.78 kJ/mol; (21)Boiling Point: 260.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0125 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCC(=O)NCCC
(2)InChI: InChI=1/C5H10ClNO/c1-2-3-7-5(8)4-6/h2-4H2,1H3,(H,7,8)
(3)InChIKey: SHWUYQDIJUWTPM-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C5H10ClNO/c1-2-3-7-5(8)4-6/h2-4H2,1H3,(H,7,8)
(5)Std. InChIKey: SHWUYQDIJUWTPM-UHFFFAOYSA-N