cis-1,4-Cyclohexanedicarboxybic acid supplier

Name
cis-1,4-Cyclohexanedicarboxybic acid
EINECS
CAS No. 619-81-8
Article Data40
CAS DataBase
Density 1.314 g/cm³
Solubility
Melting Point 168 °C
Formula C₈H₁₂O₄
Boiling Point 384.1 °C at 760 mmHg
Molecular Weight 172.181
Flash Point 200.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,4-cis-Cyclohexanedicarboxylicacid;cis-1,4-Cyclohexanedicarboxylic acid;cis-Hexahydroterephthalic acid;
PSA 74.60000
LogP 0.96200

cis-1,4-Cyclohexanedicarboxybic acid Specification

The cas register number of cis-1,4-Cyclohexanedicarboxybic acid is 619-81-8. It also can be called as 1,4-Cyclohexanedicarboxylicacid, cis- and the IUPAC Name about this chemical is cyclohexane-1,4-dicarboxylic acid. It belongs to the following product categories, such as chiral, 4-Substituted Cyclohexanecarboxylic Acids and so on.

Physical properties about cis-1,4-Cyclohexanedicarboxybic acid are: (1)ACD/LogP: 0.50; (2)ACD/LogD (pH 5.5): -0.83; (3)ACD/LogD (pH 7.4): -3.96; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.09; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 52.6Å²; (12)Index of Refraction: 1.521; (13)Molar Refractivity: 39.88 cm³; (14)Molar Volume: 130.9 cm³; (15)Polarizability: 15.81x10^-24cm³; (16)Surface Tension: 57.8 dyne/cm; (17)Enthalpy of Vaporization: 69.46 kJ/mol; (18)Vapour Pressure: 5.78E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC(CCC1C(=O)O)C(=O)O
(2)InChI: InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)
(3)InChIKey: PXGZQGDTEZPERC-UHFFFAOYSA-N

Product Name

cis-1,4-Cyclohexanedicarboxybic acid

cis-1,4-Cyclohexanedicarboxybic acid Specification

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