CAS No.14315-16-3,3-AMINOBENZANILIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	14315-16-3
Name:	3-AMINOBENZANILIDE
Article Data:	23

Formula:	C₁₃H₁₂N₂O
Molecular Weight:	212.251
Synonyms:	3-Aminobenzanilide;3-Aminobenzoic acid anilide;m-Aminobenzanilide;3-Amino-N-phenylbenzamide;Benzanilide,3-amino- (6CI,8CI);
EINECS:	238-257-8
Density:	1.244 g/cm³
Melting Point:	124～125℃
Boiling Point:	323.9 °C at 760 mmHg
Flash Point:	149.7 °C
Risk Codes:	52/53
PSA:	55.12000
LogP:	3.17530

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Specification

The Benzamide,3-amino-N-phenyl-, with the CAS registry number 14315-16-3, is also known as 3-Aminobenzoic acid anilide. It belongs to the product category of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. Its EINECS registry number is 238-257-8. This chemical's molecular formula is C₁₃H₁₂N₂O and molecular weight is 212.25. Its systematic name is called 3-amino-N-phenylbenzamide. This chemical's classification code is Drug / Therapeutic Agent.

Physical properties of Benzamide,3-amino-N-phenyl-: (1)ACD/LogP: 1.65; (2)ACD/LogD (pH 5.5): 1.64; (3)ACD/LogD (pH 7.4): 1.65; (4)ACD/BCF (pH 5.5): 10.39; (5)ACD/BCF (pH 7.4): 10.49; (6)ACD/KOC (pH 5.5): 185.36; (7)ACD/KOC (pH 7.4): 187.22; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.688; (12)Molar Refractivity: 65.06 cm³; (13)Molar Volume: 170.5 cm³; (14)Surface Tension: 58.9 dyne/cm; (15)Density: 1.244 g/cm³; (16)Flash Point: 149.7 °C; (17)Enthalpy of Vaporization: 56.59 kJ/mol; (18)Boiling Point: 323.9 °C at 760 mmHg; (19)Vapour Pressure: 0.000254 mmHg at 25°C.

Preparation of Benzamide,3-amino-N-phenyl-: this chemical can be prepared by 3-nitro-benzoic acid anilide. This reaction will need reagents tin, hydrochloric acid and alcohol.

Benzamide,3-amino-N-phenyl- can be prepared by 3-nitro-benzoic acid anilide

Uses of Benzamide,3-amino-N-phenyl-: it can be used to produce N-phenyl-3-phenylamino-benzamide by heating. This reaction is a kind of Arylation. It will need reagents copper(II) acetate, triethylamine and solvent CH₂Cl₂. The yield is about 94%.

N-phenyl-3-phenylamino-benzamide can be prepared by 3-amino-benzoic acid anilide and triphenyl-bismuthine

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccccc1)c2cccc(N)c2
(2)InChI: InChI=1/C13H12N2O/c14-11-6-4-5-10(9-11)13(16)15-12-7-2-1-3-8-12/h1-9H,14H2,(H,15,16)
(3)InChIKey: KPSPULPPMWHXGE-UHFFFAOYAU

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	750mg/kg (750mg/kg)		Journal of Medicinal Chemistry. Vol. 14, Pg. 963, 1971.