CAS 243128-42-9|2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane|2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane|[2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)propyl]epoxide|[2,3...

Molecular Formula

C₈H₅F₁₁O₂

Molecular Mass

342.1065352

Exact Mass

342.01138982

InChI

InChI=1S/C8H5F11O2/c9-4(6(12,13)14,1-3-2-20-3)21-8(18,19)5(10,11)7(15,16)17/h3H,1-2H2

InChIKey

CSMFZPWRCMEYPI-UHFFFAOYSA-N

Canonic Smiles

FC(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)CC1OC1

Isomeric Smiles

O(C(F)(C(F)(F)C(F)(F)F)F)C(C(F)(F)F)(CC1CO1)F

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

4.325507

LogD (pH = 7.4)

4.325507

Log P

4.325507

Molar Refractivity

42.0989

Polarizability

16.163454

Polar Surface Area

18.46

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

2776690

IUPAC Traditional name

2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane

IUPAC name

2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane

Synonyms

[2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)propyl]epoxide[2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane[2,3,3,3-四氟-2-(七氟丙氧基)丙基]环氧乙烷

MDL Number

MFCD00155948

PubChem SID

16208553124873046

CAS Number

243128-42-9

Storage Warning

Irritant

GHS Signal Word

Warning

Safety Statements

16-23-24/25

UN Number

1993

GHS Hazard statements

H226

Personal Protective Equipment

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Packing Group

RID/ADR

UN 1993 3/PG 3

GHS Pictograms

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

MSDS Link

Download link

Risk Statements

Hazard Class

German water hazard class

Physical Property

Boiling Point

127-128 °C(lit.)

Flash Point

53 °C

127.4 °F

Refractive Index

n20/D 1.311(lit.)

Density

1.563 g/mL at 25 °C(lit.)

Product Information

Empirical Formula (Hill Notation)

C8H5F11O2

Purity

96%

No Data Available

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No Data Available

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Sigma Aldrich

496316

Packaging
1 g in glass bottle

No Data Available

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Academic Data

PubChem

2776690

IUPAC Traditional name

2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane

IUPAC name

2-[2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane

Synonyms

[2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)propyl]epoxide[2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)propyl]oxirane[2,3,3,3-四氟-2-(七氟丙氧基)丙基]环氧乙烷

MDL Number

MFCD00155948

PubChem SID

16208553124873046

CAS Number

243128-42-9

Safety Information

Physical Property

Boiling Point

127-128 °C(lit.)

Flash Point

53 °C

127.4 °F

Refractive Index

n20/D 1.311(lit.)

Density

1.563 g/mL at 25 °C(lit.)

Product Information

Empirical Formula (Hill Notation)

C8H5F11O2

Purity

96%

Sigma Aldrich

496316

Packaging
1 g in glass bottle

No Data Available

Click here to submit data

Molecule

ID:99245