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175277-06-2
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Basic Information
CAS No.: 175277-06-2
Name: 5-(3,5-DICHLOROPHENOXY)-2-FUROIC ACID
Molecular Structure:
Molecular Structure of 175277-06-2 (5-(3,5-DICHLOROPHENOXY)-2-FUROIC ACID)
Formula: C11H6Cl2O4
Molecular Weight: 273.07
Synonyms: BUTTPARK 27\08-53;5-(3,5-DICHLOROPHENOXY)-2-FUROIC ACID
Density: 1.523 g/cm3
Melting Point: 175°C
Boiling Point: 411.9 °C at 760 mmHg
Flash Point: 202.9 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 59.67000
LogP: 4.07690
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  • 5-(3,5-DICHLOROPHENOXY)-2-FUROIC ACID

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    5-(3,5-DICHLOROPHENOXY)-2-FUROIC ACID

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Specification

This chemical is called 2-Furancarboxylic acid, 5-(3,5-dichlorophenoxy)-, and its systematic name is 5-(3,5-dichlorophenoxy)furan-2-carboxylic acid. With the molecular formula of C11H6Cl2O4, its molecular weight is 273.07. The CAS registry number of this chemical is 175277-06-2.

Other characteristics of the 2-Furancarboxylic acid, 5-(3,5-dichlorophenoxy)- can be summarised as followings: (1)ACD/LogP: 4.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 0.97; (5)ACD/BCF (pH 5.5): 3.82; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20.19; (8)ACD/KOC (pH 7.4): 3.05; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 48.67 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 61.71 cm3; (15)Molar Volume: 179.2 cm3; (16)Polarizability: 24.46×10-24cm3; (17)Surface Tension: 54.1 dyne/cm; (18)Density: 1.523 g/cm3; (19)Flash Point: 202.9 °C; (20)Enthalpy of Vaporization: 70.06 kJ/mol; (21)Boiling Point: 411.9 °C at 760 mmHg; (22)Vapour Pressure: 1.59E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Clc2cc(Oc1oc(cc1)C(=O)O)cc(Cl)c2
2.InChI: InChI=1/C11H6Cl2O4/c12-6-3-7(13)5-8(4-6)16-10-2-1-9(17-10)11(14)15/h1-5H,(H,14,15)
3.InChIKey: XPYLPZDZOMBESB-UHFFFAOYAC