CAS No.458566-84-2,4,4-Difluorocyclohexanamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	458566-84-2
Name:	4,4-Difluorocyclohexanamine
Article Data:	6

Formula:	C₆H₁₁F₂N
Molecular Weight:	135.157
Synonyms:	Cyclohexanamine, 4, 4-difluoro-;
Density:	1.08 g/cm³
Boiling Point:	141.2 °C at 760 mmHg
Flash Point:	41.9 °C
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	26.02000
LogP:	2.22330

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Specification

The 4, 4-Difluorocyclohexanamine, with the CAS registry number of 458566-84-2, is also known as Cyclohexanamine, 4, 4-difluoro-. It belongs to the product category of Pharmaceutical Intermediate. This chemical's molecular formula is C₆H₁₁F₂N and molecular weight is 135.155. What's more, its systematic name is called 4, 4-Difluorocyclohexanamine.

Physical properties about 4, 4-Difluorocyclohexanamine are: (1)ACD/LogP: 0.48; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 3.24 Å²; (7)Index of Refraction: 1.421; (8)Molar Refractivity: 31.62 cm³; (9)Molar Volume: 124.4 cm³; (10)Surface Tension: 26.6 dyne/cm; (11)Density: 1.08 g/cm³; (12)Flash Point: 41.9 °C; (13)Enthalpy of Vaporization: 37.84 kJ/mol; (14)Boiling Point: 141.2 °C at 760 mmHg; (15)Vapour Pressure: 5.92 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: FC1(F)CCC(N)CC1
(2) InChI: InChI=1/C6H11F2N/c7-6(8)3-1-5(9)2-4-6/h5H,1-4,9H2
(3) InChIKey: MQOFXVWAFFJFJH-UHFFFAOYAC