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2-Ethoxy-4-amino-5-chlorobenzoic acid

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Name

2-Ethoxy-4-amino-5-chlorobenzoic acid

EINECS 600-861-8
CAS No. 108282-38-8 Density 1.376 g/cm3
PSA 72.55000 LogP 2.60030
Solubility N/A Melting Point 165-169 °C
Formula C9H10ClNO3 Boiling Point 377.708 °C at 760 mmHg
Molecular Weight 215.636 Flash Point 182.232 °C
Transport Information N/A Appearance white crystal powder
Safety Risk Codes R36/37/38
Molecular Structure Molecular Structure of 108282-38-8 (2-Ethoxy-4-amino-5-chlorobenzoic acid) Hazard Symbols Xi
Synonyms

2-Ethoxy-4-amino-5-chlorobenzoicacid;4-Amino-5-chloro-2-ethoxybenzoic acid;

Article Data 4

2-Ethoxy-4-amino-5-chlorobenzoic acid Specification

The CAS register number of Benzoic acid,4-amino-5-chloro-2-ethoxy- is 108282-38-8. It also can be called as 2-Ethoxy-4-amino-5-chlorobenzoic acid and the systematic name about this chemical is 4-amino-5-chloro-2-ethoxybenzoic acid. The molecular formula about this chemical is C9H10ClNO3 and the molecular weight is 215.64. It belongs to the following product categories, such as Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Organic Acids; (Intermediate of Mosapride Citrate ); Aromatics Compounds and so on.

Physical properties about Benzoic acid,4-amino-5-chloro-2-ethoxy- are: (1)ACD/LogP: 2.32; (2)ACD/LogD (pH 5.5): 1; (3)ACD/BCF (pH 5.5): 4; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 46; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 72.55Å2; (11)Index of Refraction: 1.6; (12)Molar Refractivity: 53.625 cm3; (13)Molar Volume: 156.703 cm3; (14)Polarizability: 21.259x10-24cm3; (15)Surface Tension: 55.421 dyne/cm; (16)Enthalpy of Vaporization: 65.984 kJ/mol; (17)Boiling Point: 377.708 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(c(OCC)cc1N)C(=O)O
(2)InChI: InChI=1/C9H10ClNO3/c1-2-14-8-4-7(11)6(10)3-5(8)9(12)13/h3-4H,2,11H2,1H3,(H,12,13)
(3)InChIKey: XWGYOMHQGQZRLC-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C9H10ClNO3/c1-2-14-8-4-7(11)6(10)3-5(8)9(12)13/h3-4H,2,11H2,1H3,(H,12,13)
(5)Std. InChIKey: XWGYOMHQGQZRLC-UHFFFAOYSA-N

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