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2298-36-4

Basic Information
CAS No.: 2298-36-4
Name: 2-(4-AMINOPHENOXY)ACETIC ACID HYDRATE
Article Data: 27
Molecular Structure:
Molecular Structure of 2298-36-4 (2-(4-AMINOPHENOXY)ACETIC ACID HYDRATE)
Formula: C8H9NO3
Molecular Weight: 167.164
Synonyms: Aceticacid, (4-aminophenoxy)- (9CI);Acetic acid, (p-aminophenoxy)- (6CI,7CI,8CI);(4-Aminophenoxy)acetic acid;(p-Aminophenoxy)acetic acid;NSC 36983;[(4-Aminophenyl)oxy]acetic acid;
EINECS: 218-947-5
Density: 1.317g/cm3
Melting Point: 132 °C
Boiling Point: 366.868 °C at 760 mmHg
Flash Point: 175.676 °C
Hazard Symbols: Xn
Risk Codes: 22
PSA: 72.55000
LogP: 1.31340
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Specification

The (4-Aminophenoxy)acetic acid with its cas register number is 2298-36-4. It also can be called as Acetic acid,2-(4-aminophenoxy)- and the IUPAC Name about this chemical is 2-(4-aminophenoxy)acetic acid. It belongs to the Phenoxyacetic Acids and Alcohols (substituted).

Physical properties about (4-Aminophenoxy)acetic acid are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 4; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 72.55Å2; (9)Index of Refraction: 1.599; (10)Molar Refractivity: 43.365 cm3; (11)Molar Volume: 126.848 cm3; (12)Polarizability: 17.191x10-24cm3; (13)Surface Tension: 58.865 dyne/cm; (14)Enthalpy of Vaporization: 64.71 kJ/mol.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1N)OCC(=O)O
(2)InChI: InChI=1S/C8H9NO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5,9H2,(H,10,11)
(3)InChIKey: GIFGMEWQGDEWKB-UHFFFAOYSA-N