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CAS No.: | 38289-30-4 |
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Name: | trans-4-Hexylcyclohexanecarboxylic acid |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C13H24O2 |
Molecular Weight: | 212.332 |
Synonyms: | trans-4-Hexylcyclohexane-1-carboxylicacid;trans-4-Hexylcyclohexanecarboxylic acid;trans-p-Hexylcyclohexane carboxylicacid; |
Density: | 0.955 g/cm3 |
Boiling Point: | 321.2 °C at 760 mmHg |
Flash Point: | 155.8 °C |
PSA: | 37.30000 |
LogP: | 3.84780 |
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The CAS register number of trans-4-Hexylcyclohexanecarboxylic acid is 38289-30-4. It also can be called as Cyclohexanecarboxylicacid, 4-hexyl-, trans- and the systematic name about this chemical is trans-4-hexylcyclohexanecarboxylic acid. The molecular formula about this chemical is C13H24O2 and the molecular weight is 212.33.
Physical properties about trans-4-Hexylcyclohexanecarboxylic acid are: (1)ACD/LogP: 4.92; (2)ACD/LogD (pH 5.5): 4.34; (3)ACD/LogD (pH 7.4): 2.58; (4)ACD/BCF (pH 5.5): 845.23; (5)ACD/BCF (pH 7.4): 14.89; (6)ACD/KOC (pH 5.5): 2955.3; (7)ACD/KOC (pH 7.4): 52.05; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 37.3Å2; (12)Index of Refraction: 1.466; (13)Molar Refractivity: 61.63 cm3; (14)Molar Volume: 222.3 cm3; (15)Polarizability: 24.43x10-24cm3; (16)Surface Tension: 34.6 dyne/cm; (17)Enthalpy of Vaporization: 61.89 kJ/mol; (18)Boiling Point: 321.2 °C at 760 mmHg; (19)Vapour Pressure: 6.27E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)[C@@H]1CC[C@@H](CCCCCC)CC1
(2)InChI: InChI=1/C13H24O2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h11-12H,2-10H2,1H3,(H,14,15)/t11-,12-
(3)InChIKey: POEBGIQSFIJHAX-HAQNSBGRBC
(4)Std. InChI: InChI=1S/C13H24O2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h11-12H,2-10H2,1H3,(H,14,15)/t11-,12-
(5)Std. InChIKey: POEBGIQSFIJHAX-HAQNSBGRSA-N