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2-Aminocyclohexanol

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Name

2-Aminocyclohexanol

EINECS N/A
CAS No. 6850-38-0 Density 1.037 g/cm3
PSA 46.25000 LogP 0.94890
Solubility N/A Melting Point 65 °C
Formula C6H13NO Boiling Point 201.1 °C at 760 mmHg
Molecular Weight 115.175 Flash Point 75.4 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 34
Molecular Structure Molecular Structure of 6850-38-0 (2-Aminocyclohexanol) Hazard Symbols IrritantXi
Synonyms

2-Aminocyclohexanol;2-Hydroxycyclohexylamine;

Article Data 89

2-Aminocyclohexanol Specification

The cas register number of 2-Aminocyclohexanol is 6850-38-0. It also can be called as 2-Aminocyclohexanol (cis- and trans- mixture) and the Systematic name about this chemical is 2-aminocyclohexan-1-ol.

Physical properties about 2-Aminocyclohexanol are: (1)ACD/LogP: -0.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.25; (4)ACD/LogD (pH 7.4): -2.78; (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: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47Å2; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 32.81 cm3; (15)Molar Volume: 111 cm3; (16)Surface Tension: 38.6 dyne/cm; (17)Density: 1.037 g/cm3; (18)Flash Point: 75.4 °C; (19)Enthalpy of Vaporization: 50.88 kJ/mol; (20)Boiling Point: 201.1 °C at 760 mmHg; (21)Vapour Pressure: 0.0773 mmHg at 25°C.

Uses of 2-Aminocyclohexanol: It reacts with acetoacetic acid ethyl ester radical to get 3-(2-hydroxy-cyclohexylamino)-but-2-enoic acid ethyl ester . This reaction needs solvent tetrahydrofuran. The reaction time is 7 days. The yield is 93 %.

When you are using this chemical, please be cautious about it as the following:
It can be causes burns. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. People must wear suitable protective clothing, gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1.SMILES: OC1CCCCC1N
2.InChI: InChI=1/C6H13NO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4,7H2 
3.InChIKey: PQMCFTMVQORYJC-UHFFFAOYAZ
4.Std. InChI: InChI=1S/C6H13NO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4,7H2

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