Perfluoropentane

HCID 12675

Basic information

CAS
678-26-2
Standard SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
NJCBUSHGCBERSK-UHFFFAOYSA-N
Molecular formula
C5F12
Average molar mass
288.03 g/mol
Monoisotopic mass
287.9808379

Names & identifiers

Preferred name
Perfluoropentane
IUPAC
1,1,1,2,2,3,3,4,4,5,5,5-dodecafluoropentane
English name
Perfluoro-n-pentane
Molecular formula
C5F12
Molecular weight
288.03

Names & synonyms

DodecafluoropentanePERFLUOROPENTANEPerflenapent678-26-2NVX-108Flutec PP50perflenapentum1,1,1,2,2,3,3,4,4,5,5,5-DodecafluoropentaneDTXSID3046613483AU1Y5CZR 41(12)DTXCID1026613
Show more names
FLUORINERTFC-87PFC-41-12DDFPNVX108r41(12)NVX 108
CHEBI:39428RefChem:860186V08DA03211-647-5Perfluoro-n-pentanePentane, dodecafluoro-n-PerfluoropentaneMFCD00042081

Database identifiers

CAS
678-26-2
PubChem CID
12675
DTXSID
DTXSID3046613
ChEMBL
CHEMBL1899801
ChEBI
CHEBI:39428
UNII
483AU1Y5CZ
EC Number
211-647-5
Nikkaji
J95.348B

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
12
Rotatable bonds
2
Heavy atoms
17

Experimental & physicochemical properties

Physical DescriptionColorless liquid; [Strem Chemicals MSDS]

Physicochemical properties

Melting point
-120 °C · -120°C
Boiling point
29 °C · 29°C
Density
1 · 1,664 g/cm3
refractive index
1.2412 · 1.2412
Flash point
29 °C · 29°C
solubility
Benzene (Soluble), Ethyl Acetate (Soluble), Methanol (Soluble)

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory InformationChemical: Pentane, dodecafluoro-
Hazards SummaryAn irritant; [Strem Chemicals MSDS] See Perfluoropropane. See 1,1,1,2,2,3,4,5,5,5-Decafluoropentane.
Hazard Classes and CategoriesSkin Irrit. 2 (100%);Eye Irrit. 2 (100%);STOT SE 3 (100%)

Toxicology

Toxicity DataLC50 (rat) = 120,000 mg/m3

Regulatory information

Regulatory InformationChemical: Pentane, dodecafluoro-

Safety data

tsca
TSCA listed
rtecs
RZ9890000
ridadr
2810
hs_code
2903493090
Toxicity
LC50 inhalation in rat: 120gm/m3
risk_code
36/37/38

Chemistry & industry

Pharmacology

ATC Code · 2 items

V - Various;V08 - Contrast media;V08D - Ultrasound contrast media;V08DA - Ultrasound contrast media;V08DA03 - Perflenapent

QV - Various;QV08 - Contrast media;QV08D - Ultrasound contrast media;QV08DA - Ultrasound contrast media;QV08DA03 - Perflenapent

MeSH Pharmacological ClassificationSubstances used to allow enhanced visualization of tissues.

Uses & manufacturing

Uses · 3 items

Inert expander of tissue spaces, liquid at room temperature, but gaseous at body temperatures; used in experimental eye surgery. [ChemIDplus]

non-polymer PFAS -> Semiconductor Industry -> Etching the SiO2 coating of the semiconductor device;non-polymer PFAS -> Cleaning compositions -> Cleaning compositions for metal surfaces;non-polymer PFAS -> Tracing and tagging -> Tracing and tagging applications;non-polymer PFAS -> Energy Sector -> Organic Rankine engines;non-polymer PFAS -> Coatings, Paints and Varnishes -> Coatings for food contact materials others than paper;non-polymer PFAS -> Refrigerant systems -> Refrigerants;non-polymer PFAS -> Particle Physics -> The Delphi detector at CERN

• Refrigerant [Ref: https://www.ashrae.org/technical-resources/standards-and-guidelines/ashrae-refrigerant-designations];• Cleaning composition for metal surfaces [Ref: CAS2019 (US5750488)];• Used for tracing and trapping [Ref: http://www.f2chemicals.com/full_range.html];• Use in organic Rankine engine [Ref: http://www.f2chemicals.com/full_range.html];• Coating composition for food contact materials/cookware [Ref: CAS2019 (CN109370426)];• Plasma etching [Ref: Coburn, J. W. 1982. Plasma-Assisted Etching. Plasma Chemistry and Plasma Processing, 2 (1).]

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing InformationPentane, 1,1,1,2,2,3,3,4,4,5,5,5-dodecafluoro-: ACTIVE

Applications

UsesDiagnostic aid. [Note—The trademark EchoGen Emulsion has been selected for the mixture of Perflenapent and Perflisopent in a ratio of 85:15, respectively.

UsesPerfluoro-n-pentane is used in method for producing bubble formulation for theranostics.

Suppliers48 total

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
常州新氟化学有限公司13275212658 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
Additional notes · 1 item

DefinitionChEBI: Perfluoropentane is a fluorocarbon that is pentane in which all of the hydrogens have been replaced by fluorines. It has a role as a radioopaque medium and an ultrasound contrast agent. It is a fluoroalkane and a fluorocarbon. It derives from a hydride of a pentane.

Related reactions

16 records

Compound notes

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