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CAS No.: | 51513-29-2 |
---|---|
Name: | METHYL CARBAMOYLACETATE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C4H7NO3 |
Molecular Weight: | 117.104 |
Synonyms: | Methyl malonate monoamide;Malonic acid monomethyl ester monoamide; |
Density: | 1.184 g/cm3 |
Melting Point: | 39-44 °C |
Boiling Point: | 263.7 °C at 760 mmHg |
Flash Point: | 161.2 °C |
Safety: | 22-24/25 |
PSA: | 69.39000 |
LogP: | -0.26490 |
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The Methyl malonamate with its cas register number is 51513-29-2. It also can be called as Malonic acid monomethyl ester monoamide and the Systematic name about this chemical is Malonic acid monomethyl ester monoamide. When you are using it, please avoid contact with skin and eyes and not breathe dust.
Physical properties about Methyl malonamate are: (1)ACD/LogP: -1.13; (2)ACD/LogD (pH 5.5): -1.13; (3)ACD/LogD (pH 7.4): -1.13; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.75; (7)ACD/KOC (pH 7.4): 5.75; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 46.61Å2; (12)Index of Refraction: 1.437; (13)Molar Refractivity: 25.92 cm3; (14)Molar Volume: 98.8 cm3; (15)Polarizability: 10.27x10-24cm3; (16)Surface Tension: 41 dyne/cm; (17)Enthalpy of Vaporization: 50.16 kJ/mol; (18)Vapour Pressure: 0.0101 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)CC(=O)OC
(2)InChI: InChI=1/C4H7NO3/c1-8-4(7)2-3(5)6/h2H2,1H3,(H2,5,6)
(3)InChIKey: LSNSJCKGQREPDW-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C4H7NO3/c1-8-4(7)2-3(5)6/h2H2,1H3,(H2,5,6)
(5)Std. InChIKey: LSNSJCKGQREPDW-UHFFFAOYSA-N