CAS No.40525-78-8,4α-Aminocyclohexan-1α-ol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	40525-78-8
Name:	4α-Aminocyclohexan-1α-ol
Article Data:	7

Formula:	C₆H₁₃NO
Molecular Weight:	115.175
Synonyms:	4-Aminocyclohexanol;Cyclohexanol, 4-amino-;4-Aminocyclohexan-1-ol;trans-4-Aminocyclohexanol;Cyclohexanol, 4-amino-, trans-;nchembio.87-comp52;AC1Q4UBN;AC1Q4UBO;AC1Q7AEQ;
Density:	1.037 g/cm³
Melting Point:	201.1 °C at 760 mmHg
Boiling Point:	75.4 °C
PSA:	46.25000
LogP:	0.94890

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Specification

The cis-4-Aminocyclohexanol with CAS registry number of 40525-78-8 is also known as Cyclohexanol, 4-amino-. The IUPAC name is 4-Aminocyclohexan-1-ol. In addition, the formula is C₆H₁₃NO and the molecular weight is 115.17.

Physical properties about cis-4-Aminocyclohexanol are: (1)ACD/LogP: -0.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.4; (4)ACD/LogD (pH 7.4): -2.97; (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)Polarizability: 13×10^-24cm³; (17)Surface Tension: 38.6 dyne/cm; (18)Density: 1.037 g/cm³; (19)Flash Point: 75.4 °C; (20)Enthalpy of Vaporization: 50.88 kJ/mol; (21)Boiling Point: 201.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0773 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: OC1CCC(N)CC1
2. InChI: InChI=1/C6H13NO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4,7H2
3. InChIKey: IMLXLGZJLAOKJN-UHFFFAOYAD
4. Std. InChI: InChI=1S/C6H13NO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4,7H2
5. Std. InChIKey: IMLXLGZJLAOKJN-UHFFFAOYSA-N