Basic Information | Post buying leads | Suppliers | Cas Database |
The Glycine,N-(3,4-dimethylphenyl)-, ethyl ester, with the CAS registry number of 2371-26-8, is also known as Ethyl N-(3,4-dimethylphenyl)glycinate. This chemical's molecular formula is C12H17NO2 and molecular weight is207.27. What's more, its IUPAC name is Ethyl 2-(3,4-dimethylanilino)acetate.
Physical properties about the Glycine,N-(3,4-dimethylphenyl)- are: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.541; (8)Molar Refractivity: 61.18 cm3; (9)Molar Volume: 194.4 cm3; (10)Surface Tension: 38.8 dyne/cm; (11)Density: 1.065 g/cm3; (12)Flash Point: 141.1 °C; (13)Enthalpy of Vaporization: 55.04 kJ/mol; (14)Boiling Point: 309.6 °C at 760 mmHg; (15)Vapour Pressure: 0.000632 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)CNc1cc(c(cc1)C)C
(2) InChI: InChI=1/C12H17NO2/c1-4-15-12(14)8-13-11-6-5-9(2)10(3)7-11/h5-7,13H,4,8H2,1-3H3
(3) InChIKey: MLVKVEGHYWZIRP-UHFFFAOYAO