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Cas Database |
| Name |
Methyl 2-methylphenylglyoxylate |
EINECS | N/A |
| CAS No. | 34966-54-6 | Density | 1.133 g/cm3 |
| PSA | 43.37000 | LogP | 1.34650 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H10O3 | Boiling Point | 273.7 °C at 760 mmHg |
| Molecular Weight | 178.188 | Flash Point | 120.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
(2-Methylphenyl)glyoxylicacid methyl ester;Methyl 2-(2-methylphenyl)-2-oxoacetate;Methyl2-methylphenylglyoxylate;Methyl o-toluoylformate;o-Tolylglyoxylic acid,methyl ester;benzeneacetic acid, 2-methyl-α-oxo-, methyl ester; |
Article Data | 25 |
Methyl 2-methylphenylglyoxylate Specification
The Benzeneacetic acid,2-methyl-a-oxo-, methyl ester, with the CAS registry number 34966-54-6, has the systematic name of methyl (2-methylphenyl)(oxo)acetate. It is also called methyl 2-oxo-2-o-tolylacetate. And the molecular formula of this chemical is C10H10O3.
The physical properties of Benzeneacetic acid,2-methyl-a-oxo-, methyl ester are as following: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 43.37 Å2; (7)Index of Refraction: 1.516; (8)Molar Refractivity: 47.51 cm3; (9)Molar Volume: 157.2 cm3; (10)Polarizability: 18.83×10-24cm3; (11)Surface Tension: 39.6 dyne/cm; (12)Density: 1.133 g/cm3; (13)Flash Point: 120.2 °C; (14)Enthalpy of Vaporization: 51.21 kJ/mol; (15)Boiling Point: 273.7 °C at 760 mmHg; (16)Vapour Pressure: 0.00563 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1C)C(=O)OC
(2)InChI: InChI=1/C10H10O3/c1-7-5-3-4-6-8(7)9(11)10(12)13-2/h3-6H,1-2H3
(3)InChIKey: QMJRGFDWGOXABE-UHFFFAOYAT
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