3-Fluoro-4-(trifluoromethyl)phenylacetic acid supplier

Name
3-FLUORO-4-(TRIFLUOROMETHYL)PHENYLACETIC ACID
EINECS
CAS No. 238754-67-1
Article Data1
CAS DataBase
Density 1.437 g/cm³
Solubility
Melting Point 88-90 °C
Formula C₉H₆F₄O₂
Boiling Point 266.6 °C at 760 mmHg
Molecular Weight 222.139
Flash Point 115.1 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 3-FLUORO-4-(TRIFLUOROMETHYL)PHENYLACETIC ACID;RARECHEM AL BO 0856;3-Fluoro-4-(trifluoromethyl)phenylaceticacid98%;Jrd-0588;4-(Carboxymethyl)-2-fluorobenzotrifluoride;4-TrifloroMethyl-3-fluoro phenyl acetic acid;2-[3-Fluoro-4-(trifluoromethyl)phenyl]acetic acid
PSA 37.30000
LogP 2.47160

3-Fluoro-4-(trifluoromethyl)phenylacetic acid Specification

The Benzeneacetic acid,3-fluoro-4-(trifluoromethyl)-, with the CAS registry number 238754-67-1, is also known as 3-Fluoro-4-(trifluoromethyl)phenylacetic acid. It belongs to the product category of Phenylacetic Acid. This chemical's molecular formula is C₉H₆F₄O₂and molecular weight is 222.136353. Its IUPAC name is called 2-[3-fluoro-4-(trifluoromethyl)phenyl]acetic acid.

Physical properties of Benzeneacetic acid,3-fluoro-4-(trifluoromethyl)-: (1)ACD/LogP: 1.55; (2)ACD/LogD (pH 5.5): -1.13; (3)ACD/LogD (pH 7.4): 0.52; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 15.3; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.451; (12)Molar Refractivity: 39.67 cm³; (13)Molar Volume: 147.1 cm³; (14)Surface Tension: 27.6 dyne/cm; (15)Density: 1.312 g/cm³; (16)Flash Point: 77.9 °C; (17)Enthalpy of Vaporization: 42.12 kJ/mol; (18)Boiling Point: 184.9 °C at 760 mmHg; (19)Vapour Pressure: 0.715 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. 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. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1CC(=O)O)F)C(F)(F)F
(2)InChI: InChI=1S/C9H6F4O2/c10-7-3-5(4-8(14)15)1-2-6(7)9(11,12)13/h1-3H,4H2,(H,14,15)
(3)InChIKey: ZFOWDXKJQNNLMW-UHFFFAOYSA-N

Product Name

3-FLUORO-4-(TRIFLUOROMETHYL)PHENYLACETIC ACID

3-Fluoro-4-(trifluoromethyl)phenylacetic acid Specification

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