Product Name

  • Name

    3'-Aminobenzanilide

  • EINECS 240-254-1
  • CAS No. 16091-26-2
  • Article Data36
  • CAS DataBase
  • Density 1.244 g/cm3
  • Solubility
  • Melting Point 124-125 °C
  • Formula C13H12N2O
  • Boiling Point 308.3 °C at 760 mmHg
  • Molecular Weight 212.251
  • Flash Point 140.3 °C
  • Transport Information
  • Appearance white crystalline and tastes slightly bitter and astringent
  • Safety 26-36/37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 16091-26-2 (3'-Aminobenzanilide)
  • Hazard Symbols IrritantXi
  • Synonyms Benzanilide,3'-amino- (6CI,8CI);3-(Benzoylamino)aniline;3-Benzamidoaniline;N-(3-Aminophenyl)benzamide;N-Benzoyl-m-phenylenediamine;m-(Benzoylamino)aniline;N-(3-aminophenyl)benzamide;benzamide, N-(3-aminophenyl)-;3-Aminobenzanilide;
  • PSA 55.12000
  • LogP 3.17530

3'-Aminobenzanilide Specification

The Benzamide,N-(3-aminophenyl)-, with the CAS registry number 16091-26-2 and EINECS registry number 240-254-1, has the systematic name and IUPAC name of N-(3-aminophenyl)benzamide. And the molecular formula of the chemical is C13H12N2O.

The characteristics of Benzamide,N-(3-aminophenyl)- are as followings: (1)ACD/LogP: 1.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.44; (4)ACD/LogD (pH 7.4): 1.48; (5)ACD/BCF (pH 5.5): 7.18; (6)ACD/BCF (pH 7.4): 7.81; (7)ACD/KOC (pH 5.5): 139.19; (8)ACD/KOC (pH 7.4): 151.54; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 23.55 Å2; (13)Index of Refraction: 1.688; (14)Molar Refractivity: 65.06 cm3; (15)Molar Volume: 170.5 cm3; (16)Polarizability: 25.79×10-24cm3; (17)Surface Tension: 58.9 dyne/cm; (18)Density: 1.244 g/cm3; (19)Flash Point: 140.3 °C; (20)Enthalpy of Vaporization: 54.9 kJ/mol; (21)Boiling Point: 308.3 °C at 760 mmHg; (22)Vapour Pressure: 0.000685 mmHg at 25°C.  

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(Nc1cccc(c1)N)c2ccccc2
(2)InChI: InChI=1/C13H12N2O/c14-11-7-4-8-12(9-11)15-13(16)10-5-2-1-3-6-10/h1-9H,14H2,(H,15,16)
(3)InChIKey: IRFCTHNJIWUUJZ-UHFFFAOYAB

Related Products

Hot Products

Post buying leads

About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia

Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog

©2008 LookChem.com,License: ICP

NO.:Zhejiang16009103

complaints:service@lookchem.com Desktop View