Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Propanedial, 2-methyl- |
EINECS | N/A |
CAS No. | 16002-19-0 | Density | 0.961 g/cm3 |
PSA | 34.14000 | LogP | 0.02030 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H6O2 | Boiling Point | 112.5 °C at 760 mmHg |
Molecular Weight | 86.0904 | Flash Point | 30.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Malonaldehyde,methyl- (6CI,7CI,8CI);Propanedial, methyl- (9CI);Methylmalonaldehyde;Methylmalondialdehyde;NSC 162796; |
Article Data | 7 |
The Propanedial, 2-methyl-, with the CAS registry number 16002-19-0, is also known as Propanedial, methyl-. This chemical's molecular formula is C4H6O2 and molecular weight is 86.0892. Its systematic name is called methylpropanedial.
Physical properties of Propanedial, 2-methyl-: (1)ACD/LogP: -0.04; (2)ACD/LogD (pH 5.5): -0.32; (3)ACD/LogD (pH 7.4): -1.82; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 11.85; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.383; (11)Molar Refractivity: 20.91 cm3; (12)Molar Volume: 89.5 cm3; (13)Surface Tension: 28.2 dyne/cm; (14)Density: 0.961 g/cm3; (15)Flash Point: 30.9 °C; (16)Enthalpy of Vaporization: 35.1 kJ/mol; (17)Boiling Point: 112.5 °C at 760 mmHg; (18)Vapour Pressure: 21.7 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=CC(C=O)C
(2)InChI: InChI=1/C4H6O2/c1-4(2-5)3-6/h2-4H,1H3
(3)InChIKey: VXYSFSCCSQAYJV-UHFFFAOYAG