CAS No.20776-61-8,2-AMINO-4,5-DICHLOROBENZOIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	20776-61-8
Name:	2-AMINO-4,5-DICHLOROBENZOIC ACID
Article Data:	8
Cas Database

Formula:	C₇H₅Cl₂NO₂
Molecular Weight:	206.028
Synonyms:	Anthranilicacid, 4,5-dichloro- (8CI);2-Amino-4,5-dichlorobenzoic acid;4,5-Dichloroanthranilic acid;
Density:	1.608g/cm³
Melting Point:	213-214℃
Boiling Point:	380.503 °C at 760 mmHg
Flash Point:	183.922 °C
Appearance:	slight yellow crystalline powder
PSA:	63.32000
LogP:	2.85500

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Specification

The Benzoic acid,2-amino-4,5-dichloro-, with CAS registry number 20776-61-8, belongs to the following product category: Phenylacetic acid. It has the systematic name of 2-amino-4,5-dichlorobenzoic acid. Besides this, it is also called 3-Amino-4,5-dichlorobenzoic acid. This chemical is a kind of slight yellow crystalline powder. And the chemical formula of this chemical is C₇H₅Cl₂NO₂.

Physical properties of Benzoic acid,2-amino-4,5-dichloro-: (1)ACD/LogP: 3.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 48; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 63.32 Å²; (13)Index of Refraction: 1.658; (14)Molar Refractivity: 47.209 cm³; (15)Molar Volume: 128.145 cm³; (16)Polarizability: 18.715×10^-24cm³; (17)Surface Tension: 67.256 dyne/cm; (18)Density: 1.608 g/cm³; (19)Flash Point: 183.922 °C; (20)Enthalpy of Vaporization: 66.314 kJ/mol; (21)Boiling Point: 380.503 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(C(O)=O)c(N)cc1Cl
(2)InChI: InChI=1/C7H5Cl2NO2/c8-4-1-3(7(11)12)6(10)2-5(4)9/h1-2H,10H2,(H,11,12)
(3)InChIKey: MQWFRBVVABTUKS-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C7H5Cl2NO2/c8-4-1-3(7(11)12)6(10)2-5(4)9/h1-2H,10H2,(H,11,12)
(5)Std. InChIKey: MQWFRBVVABTUKS-UHFFFAOYSA-N