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cis-3-Hydroxycyclobutanecarboxylic acid
- CAS:552849-33-9
- MW:116.11500
- MF:C5H8O3
The CAS register number of 3-Hydroxycyclobutanecarboxylic acid is 194788-10-8. It also can be called as Cyclobutanecarboxylic acid, 3-hydroxy- and the IUPAC name about this chemical is 3-hydroxycyclobutane-1-carboxylic acid. The molecular formula about this chemical is C5H8O3 and molecular weight is 116.11.
Physical properties about 3-Hydroxycyclobutanecarboxylic acid are: (1)ACD/LogP: -0.69; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 57.53Å2; (10)Index of Refraction: 1.565; (11)Molar Refractivity: 26.145 cm3; (12)Molar Volume: 80.214 cm3; (13)Polarizability: 10.365x10-24cm3; (14)Surface Tension: 74.59 dyne/cm; (15)Enthalpy of Vaporization: 61.438 kJ/mol; (16)Boiling Point: 290.129 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)C1CC(O)C1
(2)InChI: InChI=1/C5H8O3/c6-4-1-3(2-4)5(7)8/h3-4,6H,1-2H2,(H,7,8)
(3)InChIKey: ZSHGVMYLGGANKU-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C5H8O3/c6-4-1-3(2-4)5(7)8/h3-4,6H,1-2H2,(H,7,8)
(5)Std. InChIKey: ZSHGVMYLGGANKU-UHFFFAOYSA-N