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149947-19-3

Basic Information
CAS No.: 149947-19-3
Name: 4-Bromo-2-fluorocinnamic acid
Article Data: 5
Molecular Structure:
Molecular Structure of 149947-19-3 (4-Bromo-2-fluorocinnamic acid)
Formula: C9H6BrFO2
Molecular Weight: 245.048
Synonyms: 4-Bromo-2-fluorocinnamicacid;
Density: 1.685 g/cm3
Melting Point: 219-223 °C
Boiling Point: 337.5 °C at 760 mmHg
Flash Point: 157.9 °C
Solubility: insoluble in water
Appearance: white to light yellow crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 37/39-26
PSA: 37.30000
LogP: 2.68600
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  • 4-Bromo-2-fluorocinnamic acid

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    149947-19-3

    4-Bromo-2-fluorocinnamic acid

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    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four yearsOur key scientific leadership team has gained experience in top research and developmen

    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four years Our key scienti

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  • 4-Bromo-2-fluorocinnamic acid

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    149947-19-3

    4-Bromo-2-fluorocinnamic acid

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    Used in medicine Application:Used in medicine

    Beyond Pharmaceutical Co., Ltd was founded by a group of industry veterans, whom are expert in custom chemical and pharmaceutical field. we provide technically challenging and cos

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  • 4-BroMo-2-fluorocinnaMic acid

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    149947-19-3

    4-BroMo-2-fluorocinnaMic acid

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    High quality Application:Pharmaceutial

    Chamflyer Chemicals Co.Ltd is a fine organics manufacturing facility which located in Shanghai. We produce a wide range of boronic acids, pyridines, quinolines, indoles, oxazoles,

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  • 4-Bromo-2-fluorocinnamic acid

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    149947-19-3

    4-Bromo-2-fluorocinnamic acid

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    High quality Products with prompt delivery Package:based on customer requirement Application:organic intermediates Transportation:By air or By sea Port:any port or China

    Wuhan Chemwish Technology Co., Ltd is one of China's leading chemical corporations, which can offer customers for more than 50,000 pharmaceutical intermediates. We have a dedicated

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    Address:Room 1311, Unit 2, Block1, Innovation Road East Lake High-tech Development Zone Wuhan, Hubei,P.R. China

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  • 4-Bromo-2-fluorocinnamic acid

  • Casno:

    149947-19-3

    4-Bromo-2-fluorocinnamic acid

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    high purity Application:Drug intermediates Materials intermediates and active molecules

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

  • NovaChemistry

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Specification

The systematic name of 4-Bromo-2-fluorocinnamic acid is 3-(4-bromo-2-fluorophenyl)prop-2-enoic acid. With the CAS registry number 149947-19-3, it is also named as 2-propenoic acid, 3-(4-bromo-2-fluorophenyl)-. The product's categories are Fluoro-contained Cinnamic Acid Series; Aromatic Cinnamic Acids, Esters and Derivatives; Cinnamic Acid; Bromine Compounds; Fluorine Compounds; Carbonyl Compounds; Carboxylic Acids. It is white to light yellow crystal powder which is stable under normal temperature and pressure. Additionally, this chemical should be sealed in the container and stored in the cool and dry place.

The other characteristics of 4-Bromo-2-fluorocinnamic acid can be summarized as: (1)ACD/LogP: 3.35; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.624; (8)Molar Refractivity: 51.39 cm3; (9)Molar Volume: 145.4 cm3; (10)Polarizability: 20.37×10-24 cm3; (11)Surface Tension: 51.5 dyne/cm; (12)Density: 1.685 g/cm3; (13)Flash Point: 157.9 °C; (14)Enthalpy of Vaporization: 61.29 kJ/mol; (15)Boiling Point: 337.5 °C at 760 mmHg; (16)Vapour Pressure: 4.09E-05 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, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1. SMILES:Brc1cc(F)c(C=CC(=O)O)cc1
2. InChI:InChI=1/C9H6BrFO2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5H,(H,12,13)
3. InChIKey:SVJGKQYKYNDYMU-UHFFFAOYAF