CAS No.4190-14-1,N-(2-OXO-2-PHENYLETHYL)BENZAMIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	4190-14-1
Name:	N-(2-OXO-2-PHENYLETHYL)BENZAMIDE
Article Data:	27

Formula:	C₁₅H₁₃NO₂
Molecular Weight:	239.274
Synonyms:	Benzamide,N-phenacyl- (6CI,7CI,8CI);2-(Benzoylamino)acetophenone;2-Benzoylamino-1-phenylethanone;Muricatisine;N-Phenacylbenzamide;NSC 89758;2-Benzamidoacetophenone;N-(2-Keto-2-phenyl-ethyl)benzamide;
Density:	1.163 g/cm³
Melting Point:	125 °C
Boiling Point:	478.9 °C at 760 mmHg
Flash Point:	197.2 °C
PSA:	46.17000
LogP:	2.69020

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Specification

The Benzamide,N-(2-oxo-2-phenylethyl)-, with the CAS registry number 4190-14-1, is also known as N-(2-Keto-2-phenyl-ethyl)benzamide. This chemical's molecular formula is C₁₅H₁₃NO₂and molecular weight is 239.2692. What's more, its IUPAC name is N-Phenacylbenzamide.

Physical properties about Benzamide,N-(2-oxo-2-phenylethyl)- are: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.34; (4)ACD/LogD (pH 7.4): 2.34; (5)ACD/BCF (pH 5.5): 35.23; (6)ACD/BCF (pH 7.4): 35.23; (7)ACD/KOC (pH 5.5): 445.59; (8)ACD/KOC (pH 7.4): 445.59; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 37.38 Å²; (13)Index of Refraction: 1.59; (14)Molar Refractivity: 69.47 cm³; (15)Molar Volume: 205.7 cm³; (16)Polarizability: 27.54×10^-24cm³; (17)Surface Tension: 47.8 dyne/cm; (18)Density: 1.163 g/cm³; (19)Flash Point: 197.2 °C; (20)Enthalpy of Vaporization: 74.31 kJ/mol; (21)Boiling Point: 478.9 °C at 760 mmHg; (22)Vapour Pressure: 2.48E-09 mmHg at 25 °C.

Preparation of Benzamide,N-(2-oxo-2-phenylethyl)-: this chemical can be prepared by benzoyl chloride, 2-Amino-1-phenyl-ethanone and hydrochloride. This reaction needs reagent aq. NaHCO₃ and solvent Ethyl acetate at Ambient temperature. The reaction time is 10 hours. The yield is 90 %.

Preparation of Benzamide,N-(2-oxo-2-phenylethyl)- can be prepared by benzoyl chloride, 2-Amino-1-phenyl-ethanone and hydrochloride

Use of Benzamide,N-(2-oxo-2-phenylethyl)- : it is used to produce other chemicals. For example, it is used to produce 2,5-diphenyl-oxazole. The reaction occurs with reagent Burgess reagent and solvent tetrahydrofuran, other condition of heating for 20 min. The yield is 93 %.

Benzamide,N-(2-oxo-2-phenylethyl)- is used to produce 2,5-diphenyl-oxazole

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCC(=O)c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C15H13NO2/c17-14(12-7-3-1-4-8-12)11-16-15(18)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,18)
(3)InChIKey: MIJZKZQWQXKSPA-UHFFFAOYAC