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| CAS No.: | 6087-13-4 |
|---|---|
| Name: | 2-FLUOROPROPIONIC ACID |
| Article Data: | 18 |
| Molecular Structure: | |
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| Formula: | C3H5 F O2 |
| Molecular Weight: | 92.0699 |
| Synonyms: | Propionicacid, 2-fluoro- (6CI,7CI,8CI);(?à)-2-Fluoropropionic acid;2-Fluoropropanoic acid;2-Fluoropropionic acid;NSC 84352;a-Fluoropropionic acid; |
| Density: | 1.181 |
| Boiling Point: | 86-87/35mm |
| Flash Point: | 82 ºC |
| Solubility: | Partly miscible in water. |
| Hazard Symbols: |
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| Risk Codes: | R22;R34 |
| Safety: | 26-36/37/39-45 |
| Transport Information: | UN 3265 |
| PSA: | 37.30000 |
| LogP: | 0.42900 |
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Specification
The 2-Fluoropropionic acid with the cas registry number of 6087-13-4 belongs to the product categories of small molecule; C1 to C5; carbonyl compounds; carboxylic acids. This chemical's molecular formula is C3H5FO2 and the molecular weight is 92.07. At the same time, it is also known as Propanoic acid, 2-fluoro- and 3,4-Difluorothiophenol. Its IUPAC name and systematic name are the same which is called 2-Fluoropropanoic acid.
Physical properties about this chemical are: (1)ACD/LogP: 0.12; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.367; (8)Molar Refractivity: 17.63 cm3; (9)Molar Volume: 78.5 cm3; (10)Surface Tension: 27.7 dyne/cm; (11)Density: 1.172 g/cm3; (12)Flash Point: 49.9 °C; (13)Enthalpy of Vaporization: 43.63 kJ/mol; (14)Boiling Point: 158.9 °C at 760 mmHg; (15)Vapour Pressure: 1.34 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical that may destroy living tissue on contact may cause inflammation to the skin or other mucous membranes. Secondly, if swallow,it would like to cause burns. In case of contacting with eyes, you must immediately rinse with plenty of water and seek medical advice. Whenever you contact this chemical, pelease wear suitable protective clothing, gloves and eye/face protection. At last, in case of accident or if you feel unwell seek medical advice immediately.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(C(=O)O)C
(2)InChI: InChI=1/C3H5FO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6);
(3)InChIKey: ZVZPFTCEXIGSHM-UHFFFAOYAX;
(4)Std. InChI: InChI=1S/C3H5FO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6);
(5)Std. InChIKey: ZVZPFTCEXIGSHM-UHFFFAOYSA-N.