3-Aminocyclohexanol supplier

Name
3-Aminocyclohexanol
EINECS
CAS No. 6850-39-1
Article Data11
CAS DataBase
Density 1.037 g/cm³
Solubility
Melting Point 64-69°C
Formula C₆H₁₃NO
Boiling Point 201.1 °C at 760 mmHg
Molecular Weight 115.175
Flash Point 75.4 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 22-37/38-41
Molecular Structure
Hazard Symbols Xn
Synonyms (3-Hydroxycyclohexyl)amine;3-Aminocyclohexanol;
PSA 46.25000
LogP 0.94890

3-Aminocyclohexanol Specification

The CAS register number of 3-Aminocyclohexanol is 6850-39-1. It also can be called as Cyclohexanol, 3-amino- and the IUPAC name about this chemical is 3-aminocyclohexan-1-ol. The molecular formula about this chemical is C₆H₁₃NO and the molecular weight is 115.17. It belongs to the Pharmacetical.

Physical properties about 3-Aminocyclohexanol are: (1)ACD/LogP: -0.35; (2)ACD/LogD (pH 5.5): -3.44; (3)ACD/LogD (pH 7.4): -3.06; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 12.47Å²; (12)Index of Refraction: 1.502; (13)Molar Refractivity: 32.81 cm³; (14)Molar Volume: 111 cm³; (15)Polarizability: 13x10^-24cm³; (16)Surface Tension: 38.6 dyne/cm; (17)Flash Point: 75.4 °C; (18)Enthalpy of Vaporization: 50.88 kJ/mol; (19)Boiling Point: 201.1 °C at 760 mmHg; (20)Vapour Pressure: 0.0773 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC1CCCC(N)C1
(2)InChI: InChI=1/C6H13NO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4,7H2
(3)InChIKey: NIQIPYGXPZUDDP-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C6H13NO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4,7H2
(5)Std. InChIKey: NIQIPYGXPZUDDP-UHFFFAOYSA-N

Product Name

3-Aminocyclohexanol

3-Aminocyclohexanol Specification

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