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6303-99-7

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Basic Information
CAS No.: 6303-99-7
Name: 3-(2-aminophenoxy)propanoic acid
Article Data: 3
Cas Database
Molecular Structure:
Molecular Structure of 6303-99-7 (3-(2-aminophenoxy)propanoic acid)
Formula: C9H11NO3
Molecular Weight: 181.191
Synonyms: Propionicacid, 3-(o-aminophenoxy)- (6CI,8CI);NSC 41446;
Density: 1.263 g/cm3
Boiling Point: 338.2 °C at 760 mmHg
Flash Point: 158.3 °C
PSA: 72.55000
LogP: 1.70350
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Specification

The CAS registry number of Propanoic acid,3-(2-aminophenoxy)- is 6303-99-7. This chemical is also named as NSC41446. In addition, its molecular formula is C9H11NO3 and molecular weight is 181.1885. Its systematic name and IUPAC name are the same which is called 3-(2-aminophenoxy)propanoic acid.

Physical properties about Propanoic acid,3-(2-aminophenoxy)- are: (1)ACD/LogP: 0.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 5; (6)Index of Refraction: 1.584; (7)Molar Refractivity: 47.99 cm3; (8)Molar Volume: 143.3 cm3; (9)Surface Tension: 55.4 dyne/cm; (10)Density: 1.263 g/cm3; (11)Flash Point: 158.3 °C; (12)Enthalpy of Vaporization: 61.37 kJ/mol; (13)Boiling Point: 338.2 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CCOc1ccccc1N
(2)InChI: InChI=1/C9H11NO3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12/h1-4H,5-6,10H2,(H,11,12)
(3)InChIKey: NTKUIDWWNRLAGS-UHFFFAOYAZ