CAS 355-02-2|perfluoromethylcyclohexane|1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)cyclohexane|Perfluoro(methylcyclohexane)|Perfluoro(methylcyclohexane) 95%|(Trifluoromethyl)undecafluoroc...

General Information

Structure

Molecular Formula

C₇F₁₄

Molecular Mass

350.0525448

Exact Mass

349.97764508

Charge

InChI

InChI=1S/C7F14/c8-1(7(19,20)21)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12

InChIKey

QIROQPWSJUXOJC-UHFFFAOYSA-N

Canonic Smiles

FC1(C(F)(F)F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F

Isomeric Smiles

C1(C(C(C(C(C1(F)F)(F)C(F)(F)F)(F)F)(F)F)(F)F)(F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

4.642835

LogD (pH = 7.4)

4.642835

Log P

4.642835

Molar Refractivity

32.9501

Polarizability

13.429513

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC Traditional name

perfluoromethylcyclohexane

IUPAC name

1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)cyclohexane

Synonyms

Perfluoro(methylcyclohexane)Perfluoro(methylcyclohexane) 95%(Trifluoromethyl)undecafluorocyclohexane全氟甲基环己烷全氟甲基环己烷Perfluoro(methylcyclohexane)十一氟(三氟甲基)环己烷Perfluoromethylcyclohexane十一氟(三氟甲基)环己烷(Trifluoromethyl)undecafluorocyclohexane全氟(甲基环己烷)

Names and Identifiers

Registration numbers

CAS Number

355-02-2

PubChem SID

2485828316096975324887169

EC Number

206-573-5

MDL Number

MFCD00001468

Beilstein Number

1915981