CAS 27905-45-9|3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl prop-2-enoate|3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl prop-2-enoate|1H,1H,2H,2H-Heptadecafluorodecyl acryla...

General Information

Structure

Molecular Formula

C₁₃H₇F₁₇O₂

Molecular Mass

518.1663344

Exact Mass

518.0174592

Charge

InChI

InChI=1S/C13H7F17O2/c1-2-5(31)32-4-3-6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30/h2H,1,3-4H2

InChIKey

QUKRIOLKOHUUBM-UHFFFAOYSA-N

Canonic Smiles

C=CC(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric Smiles

FC(C(C(C(C(C(C(C(CCOC(=O)C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

7.0420732

LogD (pH = 7.4)

7.0420732

Log P

7.0420732

Molar Refractivity

64.6384

Polarizability

24.906982

Polar Surface Area

26.3

Rotatable Bonds

Lipinski's Rule of Five

false

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC Traditional name

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl prop-2-enoate

IUPAC name

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl prop-2-enoate

Synonyms

1H,1H,2H,2H-Heptadecafluorodecyl acrylate3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl acrylate3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-十七癸(氟)丙烯酸酯1H,1H,2H,2H-十七氟癸烷丙烯酰酯1H,1H,2H,2H-Perfluorodecyl acrylate1H,1H,2H,2H-全氟癸基丙烯酸酯1H,1H,2H,2H-Perfluorodecyl acrylate3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl acrylate1H,1H,2H,2H-全氟癸基丙烯酸酯1H,1H,2H,2H-Heptadecafluorodecyl acrylate3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-十七癸(氟)丙烯酸酯Acrylic acid 1H,1H,2H,2H-perfluorodecyl ester

Names and Identifiers

Registration numbers

MDL Number

MFCD00042306

CAS Number

27905-45-9

PubChem SID

2487101416097056124890161

EC Number

248-722-7

PubChem CID

119747