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Benzoic acid,2-(4-aminophenoxy)-

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Name

Benzoic acid,2-(4-aminophenoxy)-

EINECS N/A
CAS No. 67724-03-2 Density 1.311 g/cm3
PSA 72.55000 LogP 3.34050
Solubility N/A Melting Point 180-182 °C
Formula C13H11NO3 Boiling Point 410.1 °C at 760 mmHg
Molecular Weight 229.235 Flash Point 201.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 67724-03-2 (2-(4-AMINOPHENOXY)BENZENE CARBOXYLIC ACID) Hazard Symbols IrritantXi
Synonyms

p-Amino-o'-carboxydiphenylether;

 

Benzoic acid,2-(4-aminophenoxy)- Specification

The Benzoic acid,2-(4-aminophenoxy)-, with the CAS registry number 67724-03-2, is also known as ZINC03884303. This chemical's molecular formula is C13H11NO3 and molecular weight is 229.23. Its IUPAC name is called 2-(4-aminophenoxy)benzoate. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Benzoic acid,2-(4-aminophenoxy)-: (1)ACD/LogP: 1.24; (2)ACD/LogD (pH 5.5): -0.87; (3)ACD/LogD (pH 7.4): -1.85; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.651; (12)Molar Refractivity: 63.86 cm3; (13)Molar Volume: 174.8 cm3; (14)Surface Tension: 59.8 dyne/cm; (15)Density: 1.311 g/cm3; (16)Flash Point: 201.8 °C; (17)Enthalpy of Vaporization: 69.84 kJ/mol; (18)Boiling Point: 410.1 °C at 760 mmHg; (19)Vapour Pressure: 1.85E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)C(=O)[O-])OC2=CC=C(C=C2)N
(2)InChI: InChI=1S/C13H11NO3/c14-9-5-7-10(8-6-9)17-12-4-2-1-3-11(12)13(15)16/h1-8H,14H2,(H,15,16)/p-1
(3)InChIKey: QHUNNXCUJKOGMN-UHFFFAOYSA-M

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