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103273-72-9

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Basic Information
CAS No.: 103273-72-9
Name: 2-chloro-4-acetamidoacetophenone
Molecular Structure:
Molecular Structure of 103273-72-9 (2-chloro-4-acetamidoacetophenone)
Formula: C10H10ClNO2
Molecular Weight: 211.648
Synonyms: Acetanilide,4'-acetyl-3'-chloro-(6CI);
Density: 1.274 g/cm3
Melting Point: 109-110 °C(Solv: water (7732-18-5))
Boiling Point: 382.9 °C at 760 mmHg
Flash Point: 185.4 °C
PSA: 46.17000
LogP: 2.57400
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Specification

The Acetamide,N-(4-acetyl-3-chlorophenyl)- with CAS registry number of 103273-72-9 is also called Acetanilide,4'-acetyl-3'-chloro-(6Cl). The IUPAC name is N-(4-acetyl-3-chlorophenyl)acetamide. In addition, the formula is C10H10ClNO2 and the molecular weight is 211.6449.

Physical properties about this chemical are: (1)ACD/LogP: 1.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 13.55; (6)ACD/BCF (pH 7.4): 13.55; (7)ACD/KOC (pH 5.5): 224.88; (8)ACD/KOC (pH 7.4): 224.88; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 46.17 Å2; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 55.44 cm3; (15)Molar Volume: 165.9 cm3; (16)Polarizability: 21.98 ×10-24cm3; (17)Surface Tension: 45.8 dyne/cm; (18)Density: 1.274 g/cm3; (19)Flash Point: 185.4 °C; (20)Enthalpy of Vaporization: 63.14 kJ/mol; (21)Boiling Point: 382.9 °C at 760 mmHg; (22)Vapour Pressure: 4.56E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)c1ccc(cc1Cl)NC(C)=O
(2)InChI: InChI=1/C10H10ClNO2/c1-6(13)9-4-3-8(5-10(9)11)12-7(2)14/h3-5H,1-2H3,(H,12,14)
(3)InChIKey: XUQMKUAJGHLWEP-UHFFFAOYAS