Molecular structure of Dimethyl 2-methylterephthalate (CAS NO.14186-60-8) is:
Product Name: Dimethyl 2-methylterephthalate
CAS Registry Number: 14186-60-8
IUPAC Name: Dimethyl 2-methylbenzene-1,4-dicarboxylate
Molecular Weight: 208.21058 [g/mol]
Molecular Formula: C11H12O4
XLogP3-AA: 2
H-Bond Donor: 0
H-Bond Acceptor: 4
EINECS: 238-039-2
Index of Refraction: 1.513
Molar Refractivity: 54.62 cm3
Molar Volume: 181.4 cm3
Surface Tension: 39.3 dyne/cm
Density: 1.147 g/cm3
Flash Point: 143.7 °C
Enthalpy of Vaporization: 53.49 kJ/mol
Boiling Point: 295.2 °C at 760 mmHg
Vapour Pressure: 0.00155 mmHg at 25°C
Canonical SMILES: CC1=C(C=CC(=C1)C(=O)OC)C(=O)OC
InChI: InChI=1S/C11H12O4/c1-7-6-8(10(12)14-2)4-5-9(7)11(13)15-3/h4-6H,1-3H3
InChIKey: DXIRJLBDSXBZCS-UHFFFAOYSA-N
Dimethyl 2-methylterephthalate , its cas register number is 14186-60-8. It also can be called Dimethyl 2-methyl-1,4-benzenedicarboxylate ; Dimethyl 3-methylterephthalate ; 1,4-Benzenedicarboxylic acid, 2-methyl-, 1,4-dimethyl ester ; 1,4-Benzenedicarboxylic acid, 2-methyl-, dimethyl ester .
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