Carbonic acid, methylpropyl ester (56525-42-9)

The systematic name about this chemical is methyl propyl carbonate. The CAS register number of Methyl propyl carbonate is 56525-42-9. It also can be called as carbonic acid, methyl propyl ester.

Physical properties about Methyl propyl carbonate are: (1)ACD/LogP:  1.09; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  1; (4)ACD/LogD (pH 7.4):  1; (5)ACD/BCF (pH 5.5):  5; (6)ACD/BCF (pH 7.4):  5; (7)ACD/KOC (pH 5.5):  108; (8)ACD/KOC (pH 7.4):  108; (9)#H bond acceptors:  3; (10)#H bond donors:  0; (11)#Freely Rotating Bonds:  4; (12)Polar Surface Area:  35.53Ų; (13)Index of Refraction:  1.391; (14)Molar Refractivity:  28.733 cm³; (15)Molar Volume:  120.914 cm³; (16)Surface Tension:  26.943 dyne/cm; (17)Density:  0.977 g/cm³; (18)Flash Point:  37.86 °C; (19)Enthalpy of Vaporization:  35.233 kJ/mol; (20)Boiling Point:  113.855 °C at 760 mmHg; (21)Vapour Pressure:  20.425 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: O=C(OC)OCCC
2.InChI: InChI=1/C5H10O3/c1-3-4-8-5(6)7-2/h3-4H2,1-2H3 
3.InChIKey: KKQAVHGECIBFRQ-UHFFFAOYAQ
4.Std. InChI: InChI=1S/C5H10O3/c1-3-4-8-5(6)7-2/h3-4H2,1-2H3