CAS 34761-47-2|2,4,4,5,7,7,8,10,10,11,13,13,14,14,15,15,15-heptadecafluoro-2,5,8,11-tetrakis(trifluoromethyl)-3,6,9,12-tetraoxapentadecanoyl fluoride|2,4,4,5,7,7,8,10,10,11,13,13,14,14,15,15,15-hept...

General Information

Structure

Molecular Formula

C₁₅F₃₀O₅

Molecular Mass

830.109596

Exact Mass

829.9266697

Charge

InChI

InChI=1S/C15F30O5/c16-1(46)2(17,7(23,24)25)47-13(40,41)4(20,9(29,30)31)49-15(44,45)6(22,11(35,36)37)50-14(42,43)5(21,10(32,33)34)48-12(38,39)3(18,19)8(26,27)28

InChIKey

QDHLRGOEEBWEIB-UHFFFAOYSA-N

Canonic Smiles

FC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F

Isomeric Smiles

O=C(C(OC(C(OC(C(OC(C(OC(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

11.40206

LogD (pH = 7.4)

11.40206

Log P

11.40206

Molar Refractivity

84.8066

Polarizability

32.989853

Polar Surface Area

53.99

Rotatable Bonds

Lipinski's Rule of Five

false

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC Traditional name

2,4,4,5,7,7,8,10,10,11,13,13,14,14,15,15,15-heptadecafluoro-2,5,8,11-tetrakis(trifluoromethyl)-3,6,9,12-tetraoxapentadecanoyl fluoride

IUPAC name

2,4,4,5,7,7,8,10,10,11,13,13,14,14,15,15,15-heptadecafluoro-2,5,8,11-tetrakis(trifluoromethyl)-3,6,9,12-tetraoxapentadecanoyl fluoride

Synonyms

Perfluoro-2,5,8,11-tetramethyl-3,6,9,12-tetraoxapentadecanoyl fluoridePerfluoro-2,5,8,11-tetramethyl-3,6,9,12-tetraoxapentadecanoyl fluoride 97%全氟-2,5,8,11-四甲基-3,6,9,12-四氧杂十五酰氟HFPO pentamer acid fluoridePerfluoro-2,5,8,11-tetramethyl-3,6,9,12-tetraoxapentadecanoyl fluoride

Names and Identifiers

Registration numbers

CAS Number

PubChem CID

MDL Number

PubChem SID

Registration numbers

Properties