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N-(2-oxo-2-phenylethyl)acetamide (1846-33-9)

Identification
Name:N-(2-oxo-2-phenylethyl)acetamide
Synonyms:N-phenacylacetamide;
CAS:1846-33-9
Molecular Formula: C10H11NO2
Molecular Weight: 177.20
InChI: InChI=1/C10H11NO2/c1-8(12)11-7-10(13)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12)
Molecular Structure: (C10H11NO2) N-phenacylacetamide;
Properties
Flash Point: 178.9°C
Boiling Point: 393.3°C at 760 mmHg
Density:1.108g/cm3
Refractive index:1.527
Specification:

The N-(2-Oxo-2-phenylethyl)acetamide with the cas number 1846-33-9 is also called N-phenacylacetamide. Its molecular formula is C10H11NO2. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 0.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.43; (4)ACD/LogD (pH 7.4): 0.43; (5)ACD/BCF (pH 5.5): 1.25; (6)ACD/BCF (pH 7.4): 1.25; (7)ACD/KOC (pH 5.5): 40.73; (8)ACD/KOC (pH 7.4): 40.73; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 37.38 Å2; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 49.17 cm3; (15)Molar Volume: 159.9 cm3; (16)Polarizability: 19.49×10-24cm3; (17)Surface Tension: 41.1 dyne/cm; (18)Enthalpy of Vaporization: 64.32 kJ/mol; (19)Vapour Pressure: 2.14×10-6 mmHg at 25°C.

Preparation: This chemical can be prepared by the reaction of acetic acid anhydride and 2-amino-1-phenyl-ethanone; hydrochloride. This reaction needs reagent sodium acetate.

Uses: This chemical can prepare 2-methyl-5-phenyl-oxazole. This reaction needs reagent phosphorus pentachloride.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)CNC(=O)C
(2)InChI: InChI=1/C10H11NO2/c1-8(12)11-7-10(13)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12)
(3)InChIKey: PKAGJSPRMNFMPN-UHFFFAOYAT

Flash Point: 178.9°C
Safety Data