3-(prop-2-enylcarbamoyl)prop-2-enoic acid supplier

Name
4-oxo-4-(prop-2-en-1-ylamino)but-2-enoic acid
EINECS
CAS No. 42829-13-0
Density 1.163 g/cm³
Solubility
Melting Point
Formula C₇H₉NO₃
Boiling Point 383.9 °C at 760 mmHg
Molecular Weight 155.1513
Flash Point 186 °C
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PSA
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3-(prop-2-enylcarbamoyl)prop-2-enoic acid Specification

3-(prop-2-enylcarbamoyl)prop-2-enoic acid is an organic compound with the formula C₇H₉NO₃. With the CAS registry number 42829-13-0, it is also named as (2Z)-4-oxo-4-(prop-2-en-1-ylamino)but-2-enoic acid . Besides, its molecular weight is 155.1513g/mol.

The physical properties of 3-(prop-2-enylcarbamoyl)prop-2-enoic acid are: (1)ACD/LogP: -0.14; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 46.61 Å²; (6)Index of Refraction: 1.503; (7)Molar Refractivity: 39.45 cm³; (8)Molar Volume: 133.3 cm³; (9)Polarizability: 15.63× 10^-24cm³; (10)Surface Tension: 43 dyne/cm; (11)Density: 1.163 g/cm³; (12)Flash Point: 186 °C; (13)Enthalpy of Vaporization: 69.44 kJ/mol; (14)Boiling Point: 383.9 °C at 760 mmHg; (15)Vapour Pressure: 5.87E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NC\C=C)C=CC(=O)O ;
(2)InChI: InChI=1/C7H9NO3/c1-2-5-8-6(9)3-4-7(10)11/h2-4H,1,5H2,(H,8,9)(H,10,11) ;
(3)InChIKey: SZYZSIWKJQRNIE-UHFFFAOYAE ;
(4)Std. InChI: InChI=1S/C7H9NO3/c1-2-5-8-6(9)3-4-7(10)11/h2-4H,1,5H2,(H,8,9)(H,10,11) ;
(5)Std. InChIKey: SZYZSIWKJQRNIE-UHFFFAOYSA-N

Product Name

4-oxo-4-(prop-2-en-1-ylamino)but-2-enoic acid

3-(prop-2-enylcarbamoyl)prop-2-enoic acid Specification

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