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1485-70-7

Basic Information
CAS No.: 1485-70-7
Name: N-BENZYLBENZAMIDE
Article Data: 876
Molecular Structure:
Molecular Structure of 1485-70-7 (N-BENZYLBENZAMIDE)
Formula: C14H13NO
Molecular Weight: 211.263
Synonyms: N-Benzylbenzamide;
EINECS: 216-063-4
Density: 1.109 g/cm3
Melting Point: 104-106 °C(lit.)
Boiling Point: 428 °C at 760 mmHg
Flash Point: 256.6 °C
Appearance: White fine crystalline powder
Hazard Symbols: IrritantXi
Safety: 24/25
PSA: 29.10000
LogP: 3.00750
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    Molecular Formula: C14H13NO Formula Weight: 211.26

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Specification

The Benzamide, N-(phenylmethyl)- is an organic compound with the formula C14H13NO. The IUPAC name of this chemical is N-Benzylbenzamide. With the CAS registry number 1485-70-7, it is also named as Phenyl-N-benzylcarboxamide. The product's categories are Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides and Salts; Carbonyl Compounds; Organic Building Blocks. Besides, its molecular weight is white fine crystalline powder, which should be stored in a cool, sealed, dry, well-ventilated, lightproof place.

Physical properties about Benzamide, N-(phenylmethyl)- are: (1)ACD/LogP: 2.95; (2)ACD/LogD (pH 5.5): 2.95; (3)ACD/LogD (pH 7.4): 2.95; (4)ACD/BCF (pH 5.5): 102.18; (5)ACD/BCF (pH 7.4): 102.18; (6)ACD/KOC (pH 5.5): 954.81; (7)ACD/KOC (pH 7.4): 954.81; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 20.31 Å2; (12)Index of Refraction: 1.59; (13)Molar Refractivity: 64.36 cm3; (14)Molar Volume: 190.4 cm3; (15)Polarizability: 25.51×10-24 cm3; (16)Surface Tension: 44.7 dyne/cm; (17)Density: 1.109 g/cm3; (18)Flash Point: 256.6 °C; (19)Enthalpy of Vaporization: 68.31 kJ/mol; (20)Boiling Point: 428 °C at 760 mmHg; (21)Vapour Pressure: 1.56E-07 mmHg at 25 °C.

Preparation: this chemical can be prepared by N-Benzyl-N-nitroso-benzamide. This reaction will need reagents O2; Rose Bengal and solvent methanol. The reaction time is 1 hour. The yield is about 70%.

Uses of Benzamide, N-(phenylmethyl)-: it can be used to produce N-Benzyl-thiobenzamide. It will need reagent Lawesson's reagent and solvent benzene with reaction time of 5 hours. The yield is about 77%.

When you are using this chemical, please be cautious about it as the following: When you are using it, avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C14H13NO/c16-14(13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h1-10H,11H2,(H,15,16)
(2)InChIKey: LKQUCICFTHBFAL-UHFFFAOYAQ
(3)Std. InChI: InChI=1S/C14H13NO/c16-14(13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h1-10H,11H2,(H,15,16)
(4)Std. InChIKey: LKQUCICFTHBFAL-UHFFFAOYSA-N