-
Name
cyclobutane-1,1,3,3-tetracarboxylic acid
- EINECS
- CAS No. 7371-69-9
- Article Data1
- CAS DataBase
- Density 1.986 g/cm3
- Solubility
- Melting Point
- Formula C8H8O8
- Boiling Point 249.2 °C at 760 mmHg
- Molecular Weight 232.147
- Flash Point 118.8 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms LogP
- PSA 149.20000
- LogP -0.90860
Cyclobutane-1,1,3,3-tetracarboxylic acid Specification
This chemical is called Cyclobutane-1,1,3,3-tetracarboxylic acid. With the molecular formula of C8H8O8, its molecular weight is 232.14. The CAS registry number of this chemical is 7371-69-9.
Other characteristics of the Cyclobutane-1,1,3,3-tetracarboxylic acid can be summarised as followings: (1)ACD/LogP: -0.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.98; (4)ACD/LogD (pH 7.4): -5.58; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 8; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 105.2 Å2; (13)Index of Refraction: 1.651; (14)Molar Refractivity: 42.68 cm3; (15)Molar Volume: 116.8 cm3; (16)Polarizability: 16.92×10-24cm3; (17)Surface Tension: 140.3 dyne/cm; (18)Density: 1.986 g/cm3; (19)Flash Point: 118.8 °C; (20)Enthalpy of Vaporization: 53.57 kJ/mol; (21)Boiling Point: 249.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00739 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)C1(C(=O)O)CC(C(=O)O)(C(=O)O)C1
2.InChI: InChI=1/C8H8O8/c9-3(10)7(4(11)12)1-8(2-7,5(13)14)6(15)16/h1-2H2,(H,9,10)(H,11,12)(H,13,14)(H,15,16)
3.InChIKey: ICDSPCREXLHCQV-UHFFFAOYAW
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