1-Butanol,3,3,4,4,4-pentafluoro- supplier

Name
3,3,4,4,4-PENTAFLUOROBUTAN-1-OL
EINECS 259-405-8
CAS No. 54949-74-5
Density 1.374 g/cm³
Solubility
Melting Point
Formula C₄H₅F₅O
Boiling Point 69.7 °C at 760 mmHg
Molecular Weight 164.075
Flash Point
Transport Information
Appearance
Safety 16
Risk Codes 10
Molecular Structure
Hazard Symbols F
Synonyms 2-(Perfluoroethyl)ethanol;
PSA 20.23000
LogP 1.56640

1-Butanol,3,3,4,4,4-pentafluoro- Specification

The 1-Butanol,3,3,4,4,4-pentafluoro-, with CAS registry number 54949-74-5, has the systematic name of 3,3,4,4,4-pentafluorobutan-1-ol. Besides this, it is also called Pentafluorobutanol-1. The chemical formula of this chemical is C₄H₅F₅O. And its EINECS is 259-405-8. This chemical is flammable, so keep it away from sources of ignition.

Physical properties of 1-Butanol,3,3,4,4,4-pentafluoro-: (1)ACD/LogP: 0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.71; (4)ACD/LogD (pH 7.4): 0.71; (5)ACD/BCF (pH 5.5): 2.05; (6)ACD/BCF (pH 7.4): 2.05; (7)ACD/KOC (pH 5.5): 58.25; (8)ACD/KOC (pH 7.4): 58.25; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.307; (14)Molar Refractivity: 22.86 cm³; (15)Molar Volume: 119.4 cm³; (16)Polarizability: 9.06×10^-24cm³; (17)Surface Tension: 17.9 dyne/cm; (18)Density: 1.374 g/cm³; (19)Enthalpy of Vaporization: 36.3 kJ/mol; (20)Boiling Point: 69.7 °C at 760 mmHg; (21)Vapour Pressure: 95.3 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)C(F)(F)CCO
(2)InChI: InChI=1/C4H5F5O/c5-3(6,1-2-10)4(7,8)9/h10H,1-2H2
(3)InChIKey: JPMHUDBOKDBBLG-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C4H5F5O/c5-3(6,1-2-10)4(7,8)9/h10H,1-2H2
(5)Std. InChIKey: JPMHUDBOKDBBLG-UHFFFAOYSA-N

Product Name

3,3,4,4,4-PENTAFLUOROBUTAN-1-OL

1-Butanol,3,3,4,4,4-pentafluoro- Specification

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