The Molecular Structure of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester (CAS NO.6914-71-2):
Empirical Formula: C7H10O4
Molecular Weight: 158.1519
IUPAC: dimethyl cyclopropane-1,1-dicarboxylate
Product Categories: API intermediates;Cyclopropanes;Simple 3-Membered Ring Compounds;Cycloalkanes;C6 to C7;Carbonyl Compounds;Esters
Nominal Mass: 158 Da
Average Mass: 158.1519 Da
Monoisotopic Mass: 158.057909 Da
Index of Refraction: 1.473
Molar Refractivity: 35.64 cm3
Molar Volume: 126.8 cm3
Surface Tension: 44.6 dyne/cm
Density: 1.246 g/cm3
Flash Point: 67.2 °C
Enthalpy of Vaporization: 39.43 kJ/mol
Boiling Point: 157.6 °C at 760 mmHg
Refractive index: n20/D 1.441(lit.)
Vapour Pressure: 2.73 mmHg at 25°C
InChI
InChI=1/C7H10O4/c1-10-5(8)7(3-4-7)6(9)11-2/h3-4H2,1-2H3
Smiles
COC(=O)C1(CC1)C(=O)OC
Risk Statements: 52/53
R52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 61
S61: Avoid release to the environment. Refer to special instructions / safety data sheets
WGK Germany: 1
1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester (CAS NO.6914-71-2) is also called as 1,1-Cyclopropanedicarboxylic acid dimethyl ester ; cdm ; Dimethyl 1,1-cyclopropanedicarboxylate ; cyclopropane-1,1-dicarboxylic acid dimethyl ester ; Dimethyl 1,1-cyclopropane diformate ; Dimethyl 1,1-cyclopropane-dicarbonylate ; 1,1-Cyclopropandicarbonsuredimethylester ; Cyclopropane dicarboxylate .
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