CAS No.2925-42-0,ACETALDEHYDE BUTYL 2,2,2-TRIFLUOROETHYL ACETAL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2925-42-0
Name:	ACETALDEHYDE BUTYL 2,2,2-TRIFLUOROETHYL ACETAL

Formula:	C₈H₁₅F₃O₂
Molecular Weight:	200.201
Synonyms:	Acetaldehyde,butyl 2,2,2-trifluoroethyl acetal (6CI,8CI);1-[1-(2,2,2-trifluoroethoxy)ethoxy]butane;butane, 1-[1-(2,2,2-trifluoroethoxy)ethoxy]-;
Density:	1.053 g/cm³
Boiling Point:	159.4 °C at 760 mmHg
Flash Point:	56.2 °C
Hazard Symbols:	F
Risk Codes:	10
Safety:	16
Transport Information:	UN 1993
PSA:	18.46000
LogP:	2.72800

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Specification

The Butane,1-[1-(2,2,2-trifluoroethoxy)ethoxy]-, with the CAS registry number 2925-42-0, has the systematic name of 1-[1-(2,2,2-trifluoroethoxy)ethoxy]butane. The molecular formula of the chemical is C₈H₁₅F₃O₂. It is a kind of flammable chemical, therefore, you should not smoke while dealing with it.

The characteristics of Butane,1-[1-(2,2,2-trifluoroethoxy)ethoxy]- are as followings: (1)ACD/LogP: 3.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.08; (4)ACD/LogD (pH 7.4): 3.08; (5)ACD/BCF (pH 5.5): 128.02; (6)ACD/BCF (pH 7.4): 128.02; (7)ACD/KOC (pH 5.5): 1122.03; (8)ACD/KOC (pH 7.4): 1122.03; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.37; (14)Molar Refractivity: 43.01 cm³; (15)Molar Volume: 190 cm³; (16)Polarizability: 17.05×10^-24cm³; (17)Surface Tension: 21.8 dyne/cm; (18)Density: 1.053 g/cm³; (19)Flash Point: 56.2 °C; (20)Enthalpy of Vaporization: 37.97 kJ/mol; (21)Boiling Point: 159.4 °C at 760 mmHg; (22)Vapour Pressure: 3.26 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: FC(F)(F)COC(OCCCC)C
(2)InChI: InChI=1/C8H15F3O2/c1-3-4-5-12-7(2)13-6-8(9,10)11/h7H,3-6H2,1-2H3
(3)InChIKey: DIKMXGDAKSQQSJ-UHFFFAOYAD