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Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]-

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Name

Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]-

EINECS N/A
CAS No. 175204-35-0 Density 1.375 g/cm3
PSA 55.76000 LogP 2.43710
Solubility N/A Melting Point 76-78°C
Formula C10H9F3O4 Boiling Point 290.9 °C at 760 mmHg
Molecular Weight 250.17 Flash Point 129.7 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 175204-35-0 (DL-2-[4-(TRIFLUOROMETHOXY)PHENOXY]PROPIONIC ACID) Hazard Symbols
Synonyms

BUTTPARK 37\06-91;DL-2-[4-(TRIFLUOROMETHOXY)PHENOXY]PROPIONIC ACID;2-[4-(TRIFLUOROMETHOXY)PHENOXY]PROPANOIC ACID;DL-2-[4-(Trifluoromethoxy)phenoxy]propionic acid 97%;DL-2-[4-(Trifluoromethoxy)phenoxy]propionicacid97%;BUTTPARK 37\06-91DL-2-[4-(Trifluoromethoxy)phenoxy]propionic acid 97%

 

Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]- Specification

This chemical is called Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]-, and its systematic name is 2-[4-(trifluoromethoxy)phenoxy]propanoic acid. With the molecular formula of C10H9F3O4, its molecular weight is 250.17. The CAS registry number of this chemical is 175204-35-0.

Other characteristics of the Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]- can be summarised as followings: (1)ACD/LogP: 2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.31; (4)ACD/LogD (pH 7.4): -0.95; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.88; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.471; (14)Molar Refractivity: 50.85 cm3; (15)Molar Volume: 181.8 cm3; (16)Polarizability: 20.16×10-24cm3; (17)Surface Tension: 35.2 dyne/cm; (18)Density: 1.375 g/cm3; (19)Flash Point: 129.7 °C; (20)Enthalpy of Vaporization: 56.01 kJ/mol; (21)Boiling Point: 290.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000925 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: FC(F)(F)Oc1ccc(OC(C(=O)O)C)cc1
2.InChI: InChI=1/C10H9F3O4/c1-6(9(14)15)16-7-2-4-8(5-3-7)17-10(11,12)13/h2-6H,1H3,(H,14,15)
3.InChIKey:NVWNMNYBXVGBEN-UHFFFAOYAC

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