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オクタフルオロシクロブタン

Octafluorocyclobutane

HCID 8263
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
115-25-3
標準SMILES
FC1(F)C(F)(F)C(F)(F)C1(F)F
InChIKey
BCCOBQSFUDVTJQ-UHFFFAOYSA-N
分子式
C4F8
平均分子量
200.03 g/mol
単同位体質量
199.98722576

概要

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.

名称と識別子

優先名称
Octafluorocyclobutane
IUPAC
1,1,2,2,3,3,4,4-octafluorocyclobutane
現地名
オクタフルオロシクロブタン
英語名
Octafluorocyclobutane
分子式
C4F8
分子量
200.03

名称と別名

OctafluorocyclobutanePERFLUOROCYCLOBUTANE115-25-3CyclooctafluorobutaneFreon C-318Propellant C318Freon C 318freon c318FC-C 318R-C 318V9P1D0A21KE946
名称をさらに表示
オクタフルオロシクロブタンプロペラントC-3181,1,2,2,3,3,4,4-オクタフルオロシクロブタンフレオンC-318ペルフルオロシクロブタンパーフルオロシクロブタンパーフルオロシクロブタン、C318R318FC318RC318r-c318R C318FKWC318CFC-318FlonC318FC-C-318
DTXSID9041811CHEBI:31007RefChem:167720FKWC 318FLON C 318FRON C 318DTXCID7021811FC 318

データベース識別子

CAS
115-25-3
PubChem CID
8263
DTXSID
DTXSID9041811
ChEMBL
CHEMBL444147

物性

構造計算による物性

XLogP
1.6
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
8
回転可能結合数
0
重原子数
12
形式電荷
0
複雑度
151

実験および物理化学的性質

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

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 件

-41.4 °C

-41.4 °C

Physical Description · 4 件

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.

Gas Vapor; Liquid

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

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 6 件

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]

危険有害性情報

Regulatory Information · 4 件

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 件

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

· Some may burn but none ignite readily.

Health Hazards · 2 件

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 SummaryCauses 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]

化学と産業

薬理情報

Cellular LocationsMembrane

用途と製造

Uses · 3 件

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 件

All Other Basic Organic Chemical Manufacturing

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

応用分野 · 4 件

解説C4F8(200.03).オクタフルオロシクロブタンは,テトラフルオロエチレンの二量化によって得られる.無臭·無害の液体.凝固点-50 ℃,沸点-6 ℃.d04 1.724(液体).冷媒,エーロゾル噴射剤に用いられる.森北出版「化学辞典(第2版)

用途冷媒、熱媒 : (MERCK (14TH, 2006))

使用Refrigerant; 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.

一般的な説明Octafluorocyclobutane 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.

関連反応

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化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
ChEBI
CHEBI:31007
UNII
V9P1D0A21K
EC Number
204-075-2
Nikkaji
J380H

Liquid

物理化学的性質

融点
-41.4 °C · -41.4 °C
沸点
-6 °C · -6 °C
比重(密度)
1 · 1,48 g/cm3
屈折率
1.217 · 1.217
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 データベース
115 · 115-25-3(CAS DataBase Reference)
NISTの化学物質情報
Octafluorocyclobutane(115-25-3)
EPAの化学物質情報
Perfluorocyclobutane (115-25-3)

化学的性質

化学的特性Octafluorocyclobutane is a colorless liquefied gas with an ethereal odor. Poor warning properties at low concentrations. Asphyxiant in high concentrations. Gas density is heavier than air. Octafluorocyclobutane is an etching agent.

DOT ID and Guide1976 126
Reactive GroupFluorinated Organic Compounds
Reactivity Profile · 1 件

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 件

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 件

Press. Gas (Comp.) (69.3%)

Gases under pressure - Low pressure liquefied gas

安全と保護具

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

· 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 件

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 件

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

Immediate precautionary measure

Protective Action Criteria (PAC) · 3 件

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.

毒性情報

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

安全データ

tsca
TSCA listed
ridadr
UN 1976 (OCTAFLUOROCYCLOBUTANE (REFRIGERANT GAS RC 318))
毒性
mouse,LCLo,inhalation,78pph/2H (780000ppm),Trudy Leningradskogo Sanitarno-Gigienicheskogo Meditsinskogo Instituta. Vol. 111, Pg. 39, 1975.
hs_code
2903898060
化審法
(3)-2255
hazard_code
Xi
hazard_note
Irritant
safety_code
23-38
hazard_class
2.2

調製方法

純化方法Purify octafluorocyclobutane by trap-to-trap distillation, retaining the middle portion. [Danus Ind Eng Chem 47 144 1955, Claasen J Chem Phys 18 543 1950, Beilstein 5 III 8, 5 IV 8.]

上流・下流製品情報

下流製品

2-トリフルオロメチル-1,1,3,3,3-ペンタフルオロ-1-プロペン1,1,2-トリフルオロトリクロロエタンテトラフルオロエテン

補足説明

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