CAS 423-39-2 Perfluorobutyl iodide (HCID 67917)

概要

is a promising alternative to chlorofluorocarbon solvents used in aircraft ground maintenance operations

名称と識別子

優先名称: Perfluorobutyl iodide
IUPAC: 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodobutane
現地名: ノナフルオロブチルヨージド
英語名: Perfluorobutyl iodide
分子式: C4F9I
分子量: 345.93

名称と別名

Perfluorobutyl iodide423-39-2Nonafluoro-1-iodobutaneNonafluorobutyl iodide1,1,1,2,2,3,3,4,4-Nonafluoro-4-iodobutaneperfluoro-n-butyl iodideButane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo-N4357HS8BYDTXSID0047583n-nonafluorobutyliodidePFBI solvent4-iodoperfluorobutane

名称をさらに表示

ノナフルオロブチルヨージドノナフルオロよう化ブチル1-ヨード-1,1,2,2,3,3,4,4,4-ノナフルオロブタン1,1,1,2,2,3,3,4,4-ノナフルオロ-4-ヨードブタンペルフルオロブチルヨージド1-ヨードノナフルオロブタン1,1,2,2,3,3,4,4,4-ノナフルオロ-1-ヨードブタンよう化パーフルオロブチルパーフルオロブチルヨージドノナフルオロ-1-ヨードブタンPerfluoroiodobutaneC1014NH3uorobutyLPERFLUOROBUTYL IODODE1-Iodoperfluorobutane

RefChem:171647DTXCID80275831,1,2,2,3,3,4,4,4-nonafluoro-1-iodobutane207-025-8perfluorobutyliodide1-Iodononafluorobutanen-Nonafluorobutyl iodideC4F9I

データベース識別子

CAS: 423-39-2
PubChem CID: 67917
DTXSID: DTXSID0047583
UNII: N4357HS8BY
EC Number: 207-025-8
Nikkaji: J97.534F

物性

構造計算による物性

XLogP: 4.1
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 9
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 215

実験および物理化学的性質

Chemical ClassesOther Classes -> Halogenated Aliphatics, Saturated

PFAS · 4 件

PFAS -> Other/unspecified

PFAS -> OECD Category

SpringerMaterials PropertiesOptical coefficient

Physical Description · 2 件

Liquid

Colorless to pinkish liquid with a pungent odor; [3M MSDS]

物理化学的性質

融点: -88 °C · -88 °C
沸点: 66 · 66-67 °C
比重(密度): 2.01 g/mL · 2.01 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.3285(lit.)
闪点: None
貯蔵温度: Keep in dark place,Inert atmosphere,Room temperature
外見: 液体
比重: 2.01 · 2.010
色: クリアパープル
水溶解度: 混和しない
BRN: 1777546 · 1777546
安定性: 安定。ベースとの互換性はありません。
InChI: 1S/C4F9I/c5-1(6,3(9,10)11)2(7,8)4(12,13)14
InChIKey: PGRFXXCKHGIFSV-UHFFFAOYSA-N
SMILES: FC(F)(F)C(F)(F)C(F)(F)C(F)(F)I
CAS データベース: 423 · 423-39-2(CAS DataBase Reference)
NISTの化学物質情報: 1 · 1-Iodononafluorobutane(423-39-2)
EPAの化学物質情報: 1 · Butane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo- (423-39-2)

化学的性質

化学的特性clear colourless liquid with pungent odour

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (85.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 56 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Butane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo- 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)

Butane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 件

Causes respiratory depression in acute inhalation studies of rats; Causes excitement and arrhythmias in acute inhalation studies of dogs; Causes somnolence and changes in liver weight in 4-week intermittent inhalation studies of rats; [RTECS] A mild skin and eye irritant; [3M MSDS] See 2,2,3-Trichloroheptafluorobutane and Perfluorobutane.

Hazard Classes and CategoriesSkin Irrit. 2 (85.7%)

毒性情報

Toxicity DataLC50 (rat) = 14,000 ppm/4hr

安全データ

F: 8
wgk: 3
tsca: TSCA listed
rtecs: EK5360000
ridadr: 2810
hs_code: 29034700
risk_code: 36/37/38
安衛法: 57,57-2
hazard_code: Xi
hazard_note: Irritant/Light Sensitive
safety_code: 26-36-37/39
hazard_class: 6.1(b)
packing_group: III
Hazard Classifications: Aquatic Chronic 2
ストレージクラス: 10 - Combustible liquids

化学と産業

用途と製造

UsesUsed as a chemical intermediate; [3M MSDS]

U.S. Production2023: 1,000,000 - <5,000,000 lb

Industry UsesIntermediate

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

General Manufacturing Information · 2 件

Plastics Material and Resin Manufacturing

Butane, 1,1,1,2,2,3,3,4,4-nonafluoro-4-iodo-: ACTIVE

応用分野 · 2 件

説明Perfluorobutyl iodide (PFBI) is a promising alternative to chlorofluorocarbon solvents used in aircraft ground maintenance operations and other military and commercial operations because it cleans well, has zero ozone depletion potential, and has extremely low global warming properties. Perfluorobutyl iodides also could used as gain media for a solar-pumped laser amplifier. This compound is usually utilized as perfluoroalkyl radical precursors[1–3].

使用Perfluorobutyl Iodide is used as an organocatalyst in some polymerization reactions.