基本情報
- CAS
423-50-7- 標準SMILES
O=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
HSDJWNJDPDJOEV-UHFFFAOYSA-N- 分子式
- C6F14O2S
- 平均分子量
- 402.11 g/mol
- 単同位体質量
- 401.93954532
名称と識別子
- 優先名称
- 1-Hexanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-
- IUPAC
- 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonyl fluoride
- 現地名
- トリデカフルオロヘキサン-1-スルホニルフルオリド
- 英語名
- Perflurohexane sulphonyl fluoride
- 分子式
- C6F14O2S
- 分子量
- 402.11
名称と別名
Perfluorohexanesulphonyl fluoride1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-1-hexanesulfonyl fluorideEINECS 207-026-3DTXSID30599731-Hexanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-RefChem:230713DTXCID1040083207-026-3423-50-7perfluorohexanesulfonyl fluoridePerflurohexane sulphonyl fluoridePERFLUOROHEXANE SULPHONYL FLUORIDE
名称をさらに表示
トリデカフルオロヘキサン-1-スルホン酸フルオリドトリデカフルオロヘキサン-1-スルホニルフルオリドパーフルオロヘキサンスルホニルフルオリドトリデカフルオロヘキサン-1-スルホニル フルオリドPerfluorhexansulfonylfluoridPERFLUOROHEXAANESULFONYLFLUORIDEPerflouro hexane sulfonyl flouridePerfluorohexanesulphonylfluoride97%Perfluorohexanesulfonylfluoride,98%
Perfluorohexylsulfonyl fluoridetridecafluorohexane-1-sulfonyl fluoride1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonyl fluorideMFCD00042452C6F14O2Stridecafluorohexanesulfonyl fluoride1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-1-hexanesulfonyl Fluoride; 1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluorohexane-1-sulfonyl Fluoride; Perfluoro-1-hexanesulfonyl Fluoride; Perfluorohexanesulfonyl Fluoride; Perfluorohexylsulfonyl Fluoride; Tridecafluorohexanesulfonyl FluoridePFHSF
物性
構造計算による物性
- XLogP
- 4.7
- 極性表面積
- 42.5 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 16
- 回転可能結合数
- 5
- 重原子数
- 23
- 形式電荷
- 0
- 複雑度
- 551
実験および物理化学的性質
PFAS
PFAS -> Perfluoroalkane sulfonyl fluoride (PASF)-based substances
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS
PFAS -> Other/unspecified
物理化学的性質
- 沸点
- 114 · 114-115 °C
- 比重(密度)
- 1.785 · 1.785±0.06 g/cm3(Predicted)
- 溶解性
- Benzene (Sparingly), Methanol (Slightly)
- 外見
- liquid
- 色
- Clear
- 安定性
- Moisture Sensitive
- InChI
- InChI=1S/C6F14O2S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22
- InChIKey
- HSDJWNJDPDJOEV-UHFFFAOYSA-N
- SMILES
- C(F)(F)(S(F)(=O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
- CAS データベース
- 423 · 423-50-7(CAS DataBase Reference)
- EPAの化学物質情報
- 1 · 1-Hexanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro- (423-50-7)
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
Danger
H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Not Classified
Danger
危険有害性情報
Regulatory Information
Chemical: 1-Hexanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-
S - indicates a substance that is identified in a final Significant New Use Rule.
Substance: Perfluorohexanesulphonyl fluoride
Other Safety InformationIMAP assessments - Direct precursors to perfluoroheptanesulfonate (PFHpS), perfluorohexanesulfonate (PFHxS) and perfluoropentanesulfonate (PFPeS): Environment tier II assessment
Hazard Classes and Categories
Skin Corr. 1B (50%)
Acute toxicity - category 3
安全データ
- tsca
- TSCA listed
- ridadr
- 3265
- hs_code
- 2904990090
- risk_code
- 20/21/22-34
- hazard_code
- C
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39
化学と産業
用途と製造
Uses• Precurser [Ref: Norwegian Environment Agency. 2018. Investigation of Sources to PFHxS in the Environment (M-961).]
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information1-Hexanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-: INACTIVE
応用分野
使用Perfluorohexane Sulphonyl Fluoride (>80%) is a useful compound for preparing acrylic pressure-sensitive adhesive tape.
上流・下流製品情報
上流原料
サプライヤー100 社
常州新氟化学有限公司0519-85528066; 13275212658 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
湖南嘉航医药科技有限公司85521272 18229978283 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
関連反応
7 件
化合物ノート
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