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Octafluorocyclobutane

HCID 8263
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
115-25-3
Standard SMILES
FC1(F)C(F)(F)C(F)(F)C1(F)F
InChIKey
BCCOBQSFUDVTJQ-UHFFFAOYSA-N
Molecular formula
C4F8
Average molar mass
200.03 g/mol
Monoisotopic mass
199.98722576

Overview

Octafluorocyclobutane is a colorless nonflammable gas. It may be harmful by asphyxiation. Exposure of the container to prolonged heat or fire can cause it to rupture violently and rocket. It is used to make other chemicals.

Names & identifiers

Preferred name
Octafluorocyclobutane
IUPAC
1,1,2,2,3,3,4,4-octafluorocyclobutane
English name
Octafluorocyclobutane
Molecular formula
C4F8
Molecular weight
200.03

Names & synonyms

OctafluorocyclobutanePERFLUOROCYCLOBUTANE115-25-3CyclooctafluorobutaneFreon C-318Propellant C318Freon C 318freon c318FC-C 318R-C 318V9P1D0A21KE946
Show more names
C318R318FC318RC318r-c318R C318FKWC318CFC-318FlonC318FC-C-318
DTXSID9041811CHEBI:31007RefChem:167720FKWC 318FLON C 318FRON C 318DTXCID7021811FC 318

Database identifiers

CAS
115-25-3
PubChem CID
8263
DTXSID
DTXSID9041811
ChEMBL
CHEMBL444147
ChEBI
CHEBI:31007
UNII
V9P1D0A21K
EC Number
204-075-2
Nikkaji
J380H

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
151

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Halogenated Cyclic Hydrocarbons
PFAS · 6 items

PFAS -> PFAS identified in REACH Regulation EC No. 1272/2008

PFAS -> Other/unspecified

PFAS -> Other/unspecified

PFAS -> Intentionally added food contact chemicals

PFAS -> OECD Category

PFAS -> non-polymer

SpringerMaterials PropertiesSchoenflies notation
Food AdditivesPROPELLANT -> FDA Substance added to food
Density1.513 @ -21°C
Solubility0.0236 mg/mL at 25 °C
Boiling Point-6.04 °C @760 [mm Hg]
Melting Point · 2 items

-41.4 °C

-41.4 °C

Physical Description · 4 items

Octafluorocyclobutane is a colorless nonflammable gas. It may be harmful by asphyxiation. Exposure of the container to prolonged heat or fire can cause it to rupture violently and rocket. It is used to make other chemicals.

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 6 items

Warning

H280 (69.3%): Contains gas under pressure; may explode if heated [Warning Gases under pressure]

P273, P391, P410+P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 153 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

H280: Contains gas under pressure; may explode if heated [Warning Gases under pressure]

Hazard information

Regulatory Information · 4 items

Chemical: Cyclobutane, octafluoro-

Cyclobutane, 1,1,2,2,3,3,4,4-octafluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclobutane, 1,1,2,2,3,3,4,4-octafluoro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: Octafluorocyclobutane (EC: 204-075-2)

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelNon-Flammable Gas
Fire Hazards · 2 items

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

· Some may burn but none ignite readily.

Health Hazards · 2 items

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

· Vapors may cause dizziness or asphyxiation without warning, especially when in closed or confined areas.

Hazards Summary

Chemistry & industry

Pharmacology

Cellular LocationsMembrane

Uses & manufacturing

Uses · 3 items

Used as a refrigerant and heat-transfer medium; [Merck Index] Used to make other chemicals; [CAMEO] Used as a propellant for foods; [FDA]

• Dispersing agent for pharmaceutical [Ref: CAS2019 (US4352789)]

non-polymer PFAS -> Semiconductor Industry -> Etching the SiO2 coating of the semiconductor device

U.S. Production2023: 8,500,000 - <25,000,000 lb
Industry UsesProcessing aids not otherwise specified
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information · 2 items

All Other Basic Organic Chemical Manufacturing

Cyclobutane, 1,1,2,2,3,3,4,4-octafluoro-: ACTIVE

Applications · 3 items

DescriptionOctafluorocyclobutane is a colorless gas.Molecular weight = 200.03; Boiling point = -6℃;Freezing/Melting point = -41℃. Hazard Identification(based on NFPA-704 M Rating System): Health 2,Flammability 0, Reactivity 0. Slightly soluble (slighthydrolysis).

UsesRefrigerant; heat-transfer medium.Halocarbon 318 is used for plasma etching. When it is exposed to the RF field generated in the etching process, a gas plasma is produced that will etch silicon compounds with excellent selectivity.

General DescriptionOctafluorocyclobutane is a colorless nonflammable gas. Octafluorocyclobutane may be harmful by asphyxiation. Exposure of the container to prolonged heat or fire can cause Octafluorocyclobutane to rupture violently and rocket. Octafluorocyclobutane is used to make other chemicals.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Gas Vapor; Liquid

Non-flammable and non-toxic gas; [Merck Index] Colorless odorless liquefied gas; [Air Liquide America MSDS]

Liquid

Physicochemical properties

Melting point
-41.4 °C · -41.4 °C
Boiling point
-6 °C · -6 °C
Density
1 · 1,48 g/cm3
refractive index
1.217 · 1.217
Thermal Conductivity
0.064 W/ · 0.064 W/(m·K) at 25 ℃
Henry's Law Constant
1.2 · 1.2×10-6 mol/(m3Pa) at 25℃, Clever et al. (2005)
InChI
InChI=1S/C4F8/c5-1(6)2(7,8)4(11,12)3(1,9)10
InChIKey
BCCOBQSFUDVTJQ-UHFFFAOYSA-N
SMILES
C1(F)(F)C(F)(F)C(F)(F)C1(F)F
LogP
1.97 · 1.97
CAS DataBase Reference
115 · 115-25-3(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS)
OCTAFLUOROCYCLOBUTANE
FDA 21 CFR
173.36 · 173.360
EWG's Food Scores
2 · 2
FDA UNII
9 P1D0A21K · V9P1D0A21K
NIST Chemistry Reference
Octafluorocyclobutane(115-25-3)
EPA Substance Registry System
Perfluorocyclobutane (115-25-3)
Symbol(GHS)
4 · GHS04
Signal word
Warning
Hazard statements
315 · H315-H319-H335-H280
Precautionary statements
271 · P271-P261-P280
Hazard Codes
Xi
Safety Statements
23 · 23-38
RIDADR
1976 · UN 1976 (OCTAFLUOROCYCLOBUTANE (REFRIGERANT GAS RC 318))
Hazard Note
Irritant
TSCA
TSCA listed
HazardClass
2.2 · 2.2
HS Code
2903898060 · 2903898060
Toxicity
78 pph/2H · mouse,LCLo,inhalation,78pph/2H (780000ppm),Trudy Leningradskogo Sanitarno-Gigienicheskogo Meditsinskogo Instituta. Vol. 111, Pg. 39, 1975.
REACH Registrations
Active
Causes changes in recordings from specific areas of the CNS in 17-week intermittent inhalation studies of mice; [RTECS] May cause asphyxiation; [CAMEO] A simple asphyxiant; Evaporating liquid can cause frostbite; [Air Liquide America MSDS]
DOT ID and Guide1976 126
Reactive GroupFluorinated Organic Compounds
Reactivity Profile · 1 item

OCTAFLUOROCYCLOBUTANE is chemically inert in many situations, but can react violently with strong reducing agents such as the very active metals and the active metals. They suffer oxidation with strong oxidizing agents and under extremes of temperature.

DOT Hazard Classification · 3 items

Octafluorocyclobutane, or Refrigerant gas RC 318

UN1976

Div 2.2 Non-flammable compressed gas (49 eCFR § 173.115)

Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories · 2 items

Press. Gas (Comp.) (69.3%)

Gases under pressure - Low pressure liquefied gas

Safety & protection

Fire FightingExcerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:
Accidental Release Measures · 2 items

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch or walk through spilled material.

First Aid · 2 items

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:
Isolation and Evacuation · 2 items

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

Immediate precautionary measure

Protective Action Criteria (PAC) · 3 items

400 [ppm]

4400 [ppm]

27000 [ppm]

Personal Protective Equipment (PPE)Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:
Emergency Response Planning Guidelines· Use extinguishing agent suitable for type of surrounding fire.

Toxicology

Adverse EffectsOther Poison - Simple Asphyxiant
Toxicity DataLCLo (mouse) = 780,000 ppm/2hr

Safety data

tsca
TSCA listed
ridadr
UN 1976 (OCTAFLUOROCYCLOBUTANE (REFRIGERANT GAS RC 318))
hs_code
2903898060
Toxicity
mouse,LCLo,inhalation,78pph/2H (780000ppm),Trudy Leningradskogo Sanitarno-Gigienicheskogo Meditsinskogo Instituta. Vol. 111, Pg. 39, 1975.
Signal word
Warning
Symbol(GHS)
GHS04
hazard_code
Xi
hazard_note
Irritant
safety_code
23-38
hazard_class
2.2
Hazard statements
H315-H319-H335-H280
REACH Registrations
Active
Precautionary statements
P271-P261-P280

Upstream & downstream products

Downstream products

Perfiuoroisobutylene1,1,2-TrichlorotrifluoroethaneTetrafluoroethylene

Additional notes

DefinitionChEBI: A fluorocarbon that is cyclobutane in which all eight hydrogens are replaced by fluorines.