CAS 2374-14-3|2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-1,3,5,2,4,6-trioxatrisilinane|1,3,5-Tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane|2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoroprop...

General Information

Structure

Molecular Formula

C₁₂H₂₁F₉O₃Si₃

Molecular Mass

468.5354688

Exact Mass

468.06547811

Charge

InChI

InChI=1S/C12H21F9O3Si3/c1-25(7-4-10(13,14)15)22-26(2,8-5-11(16,17)18)24-27(3,23-25)9-6-12(19,20)21/h4-9H2,1-3H3

InChIKey

URZHQOCYXDNFGN-UHFFFAOYSA-N

Canonic Smiles

FC(CC[Si]1(C)O[Si](C)(CCC(F)(F)F)O[Si](O1)(C)CCC(F)(F)F)(F)F

Isomeric Smiles

O1[Si](O[Si](O[Si]1(C)CCC(F)(F)F)(C)CCC(F)(F)F)(CCC(F)(F)F)C

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

4.4199

LogD (pH = 7.4)

4.4199

Log P

4.4199

Molar Refractivity

69.1815

Polarizability

32.054108

Polar Surface Area

27.69

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC name

2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-1,3,5,2,4,6-trioxatrisilinane

Synonyms

1,3,5-Tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane1,3,5-Tris[(3,3,3-trifluoropropyl)methyl]-cyclotrisiloxane1,3,5-Tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane1,3,5-Trimethyl-1,3,5-tris(3,3,3-trifluoropropyl)cyclotrisiloxane1,3,5-三甲基-1,3,5-三(3,3,3-三氟丙基)环三硅噁烷

IUPAC Traditional name

2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-1,3,5,2,4,6-trioxatrisilinane

Names and Identifiers

Registration numbers

Beilstein Number

EC Number

MDL Number

CAS Number