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CAS No.: | 84228-93-3 |
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Name: | 3-(4-Pyridine)acrylic acid |
Article Data: | 27 |
Molecular Structure: | |
Formula: | C8H7NO2 |
Molecular Weight: | 149.149 |
Synonyms: | 2-Propenoicacid, 3-(4-pyridinyl)-, (E)-;(2E)-3-(Pyridin-4-yl)prop-2-enoic acid;(E)-3-(4-Pyridinyl)-2-propenoic acid;(E)-3-(4-Pyridinyl)acrylic acid;trans-3-(4-Pyridinyl)-2-propenoic acid;trans-3-(4-Pyridyl)acrylic acid;trans-3-(4-Pyridyl)propenoic acid;trans-4-Pyridineacrylic acid;trans-4-Pyridylacrylic acid; |
EINECS: | 226-265-4 |
Density: | 1.261 g/cm3 |
Melting Point: | 276-280 °C |
Boiling Point: | 317.5 °C at 760 mmHg |
Flash Point: | 145.8 °C |
Hazard Symbols: | R36/37/38:Irritating to eyes, respiratory system and skin.; |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 50.19000 |
LogP: | 1.17940 |
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The 3-(4-Pyridine)acrylic acid is an organic compound with the formula C8H7NO2. The systematic name of this chemical is (2E)-3-(pyridin-4-yl)prop-2-enoic acid. With the CAS registry number 84228-93-3, it is also named as 4-Pyridineacrylic acid. Besides, it should be stored in a closed cool and dry place.
Physical properties about 3-(4-Pyridine)acrylic acid are: (1)ACD/LogP: 0.92; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 39.19 Å2; (10)Index of Refraction: 1.624; (11)Molar Refractivity: 41.79 cm3; (12)Molar Volume: 118.2 cm3; (13)Polarizability: 16.57×10-24cm3; (14)Surface Tension: 57.8 dyne/cm; (15)Density: 1.261 g/cm3; (16)Flash Point: 145.8 °C; (17)Enthalpy of Vaporization: 59.01 kJ/mol; (18)Boiling Point: 317.5 °C at 760 mmHg; (19)Vapour Pressure: 0.00016 mmHg at 25°C.
Uses of 3-(4-Pyridine)acrylic acid: it can be used to produce 3-piperidin-4-yl-propionic acid. It will need reagent butan-1-ol, sodium.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)\C=C\c1ccncc1
(2)InChI: InChI=1/C8H7NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h1-6H,(H,10,11)/b2-1+
(3)InChIKey: SSAYTINUCCRGDR-OWOJBTEDBT
(4)Std. InChI: InChI=1S/C8H7NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h1-6H,(H,10,11)/b2-1+
(5)Std. InChIKey: SSAYTINUCCRGDR-OWOJBTEDSA-N