1,2-Cyclohexanedicarboxylicacid, 1,2-dimethyl ester, (1S,2R)-rel- (1687-29-2)

The cas register number of Dimethyl cyclohexane-1,2-dicarboxylate is 1687-29-2. It also can be called as 1,2-Cyclohexanedicarboxylicacid, 1,2-dimethyl ester, (1S,2R)-rel- and the IUPAC Name about this chemical is dimethyl cyclohexane-1,2-dicarboxylate.

Physical properties about Dimethyl cyclohexane-1,2-dicarboxylate are: (1)ACD/LogP: 1.56; (2)ACD/LogD (pH 5.5): 1.56; (3)ACD/LogD (pH 7.4): 1.56; (4)ACD/BCF (pH 5.5): 9.06; (5)ACD/BCF (pH 7.4): 9.06; (6)ACD/KOC (pH 5.5): 168.51; (7)ACD/KOC (pH 7.4): 168.51; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 52.6Ų; (11)Index of Refraction: 1.457; (12)Molar Refractivity: 49.57 cm³; (13)Molar Volume: 181.6 cm³; (14)Polarizability: 19.65x10^-24cm³; (15)Surface Tension: 36.9 dyne/cm; (16)Enthalpy of Vaporization: 49.66 kJ/mol; (17)Vapour Pressure: 0.0133 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)[C@@H]1[C@H](C(=O)OC)CCCC1
(2)InChI: InChI=1/C10H16O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h7-8H,3-6H2,1-2H3/t7-,8+
(3)InChIKey: AIACXWOETVLBIA-OCAPTIKFBU
(4)Std. InChI: InChI=1S/C10H16O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h7-8H,3-6H2,1-2H3/t7-,8+
(5)Std. InChIKey: AIACXWOETVLBIA-OCAPTIKFSA-N