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| CAS No.: | 1467-84-1 |
|---|---|
| Name: | trans-4-Aminocyclohexanemethanol |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C7H15NO |
| Molecular Weight: | 129.202 |
| Synonyms: | (trans-4-Aminocyclohexyl)methanol;trans-4-Aminocyclohexanemethanol;((1R,4r)-4-aMinocyclohexyl)Methanol |
| Density: | 0.974 g/cm3 |
| Melting Point: | 146-148?C |
| Boiling Point: | 218.796 °C at 760 mmHg |
| Flash Point: | 86.125 °C |
| Appearance: | White solid |
| PSA: | 46.25000 |
| LogP: | 1.19650 |
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- Total:32 Page 1 of 1 1
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Specification
The Cyclohexanemethanol, 4-amino-, trans- has CAS registry number 1467-84-1. It belongs to the product categories of Chemical Amines; Amine; Metabolites & Impurities. This chemical's molecular formula is C7H15NO and molecular weight is 129.20. What's more, its systematic name is (trans-4-Aminocyclohexyl)methanol.
Physical properties of Cyclohexanemethanol, 4-amino-, trans- are: (1)ACD/LogP: 0.13; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 46.25 Å2; (11)Index of Refraction: 1.477; (12)Molar Refractivity: 37.452 cm3; (13)Molar Volume: 132.596 cm3; (14)Polarizability: 14.847×10-24cm3; (15)Surface Tension: 38.912 dyne/cm; (16)Density: 0.974 g/cm3; (17)Flash Point: 86.125 °C; (18)Enthalpy of Vaporization: 52.934 kJ/mol; (19)Boiling Point: 218.796 °C at 760 mmHg; (20)Vapour Pressure: 0.026 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: C1[C@@H](CC[C@H](C1)N)CO
(2)Std. InChI: InChI=1S/C7H15NO/c8-7-3-1-6(5-9)2-4-7/h6-7,9H,1-5,8H2/t6-,7-
(3)Std. InChIKey: GHUJZOFJZVGTSN-LJGSYFOKSA-N