Specification: |
The 3-(4-Amino-3-pyridinyl)-2-propenoic acid, its cas register number is 773132-83-5. It also can be called as 2-Propenoic acid,3-(4-amino-3-pyridinyl)- and the Systematic name about this chemical is 3-(4-amino-3-pyridyl)prop-2-enoic acid.
Physical properties about 3-(4-Amino-3-pyridinyl)-2-propenoic acid are: (1)#H bond acceptors: 4; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 76.21Å2; (5)Index of Refraction: 1.689; (6)Molar Refractivity: 46.03 cm3; (7)Molar Volume: 120.5 cm3; (8)Polarizability: 18.24x10-24cm3; (9)Surface Tension: 72.7 dyne/cm; (10)Enthalpy of Vaporization: 70.58 kJ/mol; (11)Vapour Pressure: 1.13E-07 mmHg at 25°C
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)C=Cc1cnccc1N
(2)InChI: InChI=1/C8H8N2O2/c9-7-3-4-10-5-6(7)1-2-8(11)12/h1-5H,(H2,9,10)(H,11,12)
(3)InChIKey: DVXPOYXSNKWPOE-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C8H8N2O2/c9-7-3-4-10-5-6(7)1-2-8(11)12/h1-5H,(H2,9,10)(H,11,12)
(5)Std. InChIKey: DVXPOYXSNKWPOE-UHFFFAOYSA-N
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