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128895-76-1

Basic Information
CAS No.: 128895-76-1
Name: 2-FLUORO-4-N-OCTYLOXYBENZOIC ACID
Article Data: 2
Molecular Structure:
Molecular Structure of 128895-76-1 (2-FLUORO-4-N-OCTYLOXYBENZOIC ACID)
Formula: C15H21FO3
Molecular Weight: 268.32
Synonyms: 2-Fluoro-4-(octyloxy)benzoicacid;2-Fluoro-4-n-octyloxybenzoic acid;
Density: 1.091 g/cm3
Boiling Point: 364 °C at 760 mmHg
Flash Point: 174 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 46.53000
LogP: 4.26320
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  • Benzoicacid, 2-fluoro-4-(octyloxy)-

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    Benzoicacid, 2-fluoro-4-(octyloxy)-

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  • Benzoicacid, 2-fluoro-4-(octyloxy)-

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    Benzoicacid, 2-fluoro-4-(octyloxy)-

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  • Benzoicacid, 2-fluoro-4-(octyloxy)-

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    Benzoicacid, 2-fluoro-4-(octyloxy)-

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    factory?direct?sale Application:Fine chemical intermediates, used as the main raw material for the synthesis of various pesticides, medicines, surfactants, polymer monomers, and antifungal agents

    Antimex Chemical Limied, was founded in 2001, we are specializing in manufacturing & researching of Active pharmaceutical Ingredients,Veterinary pharm APIs,cosmetic ingredients,and

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  • 2-FLUORO-4-(N-OCTYLOXY)BENZOIC ACID

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    2-FLUORO-4-(N-OCTYLOXY)BENZOIC ACID

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    2-FLUORO-4-(N-OCTYLOXY)BENZOIC ACIDAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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  • Benzoicacid, 2-fluoro-4-(octyloxy)-

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    Benzoicacid, 2-fluoro-4-(octyloxy)-

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    2-FLUORO-4-N-OCTYLOXYBENZOIC ACID

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Specification

The Benzoicacid, 2-fluoro-4-(octyloxy)-, with the CAS registry number 128895-76-1, is also known as 2-Fluoro-4-n-octyloxybenzoic acid. This chemical's molecular formula is C15H21FO3 and molecular weight is 268.32. What's more, its systematic name is 2-Fluoro-4-(octyloxy)benzoic acid and it belongs to the product categories of Acids & Esters; Anisoles, Alkyloxy Compounds & Phenylacetates; Fluorine Compounds.

Physical properties of Benzoicacid, 2-fluoro-4-(octyloxy)- are: (1)ACD/LogP: 5.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.77; (4)ACD/LogD (pH 7.4): 2.62; (5)ACD/BCF (pH 5.5): 147.75; (6)ACD/BCF (pH 7.4): 10.58; (7)ACD/KOC (pH 5.5): 352.59; (8)ACD/KOC (pH 7.4): 25.26; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 72.28 cm3; (15)Molar Volume: 245.7 cm3; (16)Polarizability: 28.65×10-24 cm3; (17)Surface Tension: 38.4 dyne/cm; (18)Density: 1.091 g/cm3; (19)Flash Point: 174 °C; (20)Enthalpy of Vaporization: 64.38 kJ/mol; (21)Boiling Point: 364 °C at 760 mmHg; (22)Vapour Pressure: 6.15E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccc(OCCCCCCCC)cc1F
(2)InChI: InChI=1/C15H21FO3/c1-2-3-4-5-6-7-10-19-12-8-9-13(15(17)18)14(16)11-12/h8-9,11H,2-7,10H2,1H3,(H,17,18)
(3)InChIKey: AWPDESKDPDUKRX-UHFFFAOYSA-N