Name: 2,2,2-TRICHLORO-N,N-DIMETHYLACETAMIDE
SKU: 7291-33-0

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Basic Information

Molecular Structure:
CAS No.:	7291-33-0
Name:	2,2,2-TRICHLORO-N,N-DIMETHYLACETAMIDE
Article Data:	12

Formula:	C₄H₆Cl₃NO
Molecular Weight:	190.457
Synonyms:	2,2,2-Trichloro-N,N-dimethylacetamide;Dimethyltrichloroacetamide;N,N-Dimethyl-2,2,2-trichloroacetamide;N,N-Dimethyl-a,a,a-trichloroacetamide;N,N-Dimethyltrichloroacetamide;
Density:	1.43 g/cm³
Melting Point:	12°C
Boiling Point:	185.4 °C at 760 mmHg
Flash Point:	65.9 °C
PSA:	20.31000
LogP:	1.44480

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Specification

This chemical is called Acetamide, 2,2,2-trichloro-N,N-dimethyl-, and its IUPAC name is 2,2,2-trichloro-N,N-dimethylacetamide. With the molecular formula of C₄H₆Cl₃NO, its molecular weight is 190.46. The CAS registry number of this chemical is 7291-33-0.

Other characteristics of the Acetamide, 2,2,2-trichloro-N,N-dimethyl- can be summarised as followings: (1)ACD/LogP: 1.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.19; (4)ACD/LogD (pH 7.4): 1.19; (5)ACD/BCF (pH 5.5): 4.73; (6)ACD/BCF (pH 7.4): 4.73; (7)ACD/KOC (pH 5.5): 105.77; (8)ACD/KOC (pH 7.4): 105.77; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.495; (14)Molar Refractivity: 38.84 cm³; (15)Molar Volume: 133.1 cm³; (16)Polarizability: 15.39×10^-24cm³; (17)Surface Tension: 38.8 dyne/cm; (18)Density: 1.43 g/cm³; (19)Flash Point: 65.9 °C; (20)Enthalpy of Vaporization: 42.16 kJ/mol; (21)Boiling Point: 185.4 °C at 760 mmHg; (22)Vapour Pressure: 0.698 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: ClC(Cl)(Cl)C(=O)N(C)C
2.InChI: InChI=1/C4H6Cl3NO/c1-8(2)3(9)4(5,6)7/h1-2H3
3.InChIKey: WGBMKQSRUSKSOM-UHFFFAOYAN