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基本情報
- CAS
163702-08-7- 標準SMILES
COC(F)(F)C(F)(C(F)(F)F)C(F)(F)F- InChIKey
DJXNLVJQMJNEMN-UHFFFAOYSA-N- 分子式
- C5H3F9O
- 平均分子量
- 250.06 g/mol
- 単同位体質量
- 250.0040187
概要
See also: Glycerin; methyl perfluoroisobutyl ether (component of).
名称と識別子
- 優先名称
- Methyl perfluoroisobutyl ether
- IUPAC
- 2-[difluoro(methoxy)methyl]-1,1,1,2,3,3,3-heptafluoropropane
- 現地名
- メチルパーフルオロイソブチルエーテル
- 英語名
- Methyl perfluoroisobutyl ether
- 分子式
- C5H3F9O
- 分子量
- 250.06
名称と別名
Methyl perfluoroisobutyl ether163702-08-7perfluoroisobutyl methyl etherPropane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro-HI89P35AAXmethyl nonafluoroisobutyl etherDTXSID5042326UNII-HI89P35AAX1,1,2,3,3,3-HEXAFLUORO-1-METHOXY-2-(TRIFLUOROMETHYL)PROPANE2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoropropanemethylperfluorobutyletherRefChem:157993
名称をさらに表示
メチルパーフルオロイソブチルエーテルメチル(ノナフルオロイソブチル)エーテル1-メトキシ-2-(トリフルオロメチル)-1,1,2,3,3,3-ヘキサフルオロプロパンメチルノナフルオロイソブチルエーテル1,1,2,3,3,3-ヘキサフルオロ-1-メトキシ-2-(トリフルオロメチル)プロパン1,1,1,2,3,3-ヘキサフルオロ-3-メトキシ-2-(トリフルオロメチル)プロパン(ノナフルオロイソブチル)メチルエーテルメチル1,1,2,3,3,3-ヘキサフルオロ-2-(トリフルオロメチル)プロピルエーテルメチル[1,1,2,3,3,3-ヘキサフルオロ-2-(トリフルオロメチル)プロピル]エーテルMethyl perfluoroisobutyl ether(NOVEC 7100i 7100FNM7100Noah 7100(NOVEC 7100250kg/Drum)FlexDasin HND-7200HFE-7100 (25kg/Drum
DTXCID301020834METHYL PERFLUOROISOBUTYL ETHER [INCI]VF45 (TM) HFEBased Cleaning Fluid, VOL0570APropane, 2(difluoromethoxymethyl)1,1,1,2,3,3,3heptafluoro422-270-2605-340-92-[difluoro(methoxy)methyl]-1,1,1,2,3,3,3-heptafluoropropane1,1,1,2,3,3-hexafluoro-3-methoxy-2-(trifluoromethyl)propane
データベース識別子
- CAS
163702-08-7- PubChem CID
- 4156734
- DTXSID
DTXSID5042326- ChEMBL
CHEMBL477673- UNII
- HI89P35AAX
- EC Number
- 422-270-2、605-340-9
- Nikkaji
- J1.292.804A
物性
構造計算による物性補完中
- XLogP
- 3.3
- 極性表面積
- 9.2 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 10
- 回転可能結合数
- 2
- 重原子数
- 15
- 形式電荷
- 0
- 複雑度
- 212
実験および物理化学的性質
Chemical ClassesOther Classes -> Halogenated Ethers
PFAS
PFAS -> Hydrofluoroether
PFAS -> OECD Category
PFAS -> Suspected persistent, mobile, toxic (PMT) PFAS or PFAS-like compounds
PFAS -> Other/unspecified
PFAS -> non-polymer
Vapor Pressure202.0 [mmHg]
Physical Description
Liquid
Clear colorless liquid with a mild ethereal odor; [3M MSDS]
物理化学的性質
- 沸点
- 20 · 20.0±40.0℃ (760 Torr)
- 比重(密度)
- 1.5 · 1.500±0.06 g/cm3 (20 ºC 760 Torr)
- 闪点
- -29.6 · -29.6±23.2℃
- 化粧品成分の機能
- 溶媒粘度制御
- InChI
- InChI=1S/C5H3F9O/c6-2(7)15-1-3(8,4(9,10)11)5(12,13)14/h2H,1H2
- InChIKey
- JZYGTCBELUZFGX-UHFFFAOYSA-N
- SMILES
- C(F)(F)(F)C(COC(F)F)(F)C(F)(F)F
- LogP
- 3.216 · 3.216 (est)
- CAS データベース
- 163702 · 163702-08-7
- EPAの化学物質情報
- 2 · Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro- (163702-08-7)
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
This chemical does not meet GHS hazard criteria for 78.6% (202 of 257) of all reports.
Warning
H332 (19.8%): Harmful if inhaled [Warning Acute toxicity, inhalation]
P261, P271, P304+P340, and P317 (click each P-code to see the statement)
Aggregated GHS information provided per 257 reports by companies from 4 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 90% (9 of 10) of all reports.
危険有害性情報
Regulatory Information
Chemical: Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro-
Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 08-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/10496
Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards Summary
Perfluorobutyl methyl ether (Mixed Isomers), also known as Hydrofluoroether-7100 (HFE-7100), is a mixture of approximately 40% methyl nonafluorobutyl ether (CAS# 163702-07-6) and 60% methyl nonafluoroisobutyl ether (CAS# 163702-08-7); Causes eye irritation; [OSHA] A mixture of 20-80% methyl nonafluoroisobutyl ether (CAS# 163702-08-7) and methyl nonafluorobutyl ether (CAS# 163702-07-6); Not expected to cause significant skin or eye irritation; [3M MSDS]
Hazard Classes and Categories
Aquatic Chronic 4 (10%)
Acute Tox. 4 (19.8%)
毒性情報
Adverse EffectsNeurotoxin - Acute solvent syndrome
安全データ
- tsca
- TSCA listed
- 化審法
- 新規公示化学物質（2011年3月31日以前届出）
化学と産業
用途と製造
Uses
Used as a cleaning solvent; [3M MSDS]
Metal Degreasing [Category: Clean]
• Spot-free water drying agent [Ref: 3M. 2009a. 3MTM NovecTM 7100 Engineered Fluid - Product Information.]
non-polymer PFAS -> Cleaning compositions -> Cleaning compositions in general
U.S. Production2023: 1,000,000 - <5,000,000 lb
Industry UsesCleaning agent
Household ProductsInformation on 3 consumer products that contain Methyl Perfluoroisobutyl Ether in the following categories is provided:
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information
Computer and Electronic Product Manufacturing
Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro-: ACTIVE
応用分野
説明Methyl perfluoro isobutyl ether: a unique fluorinated ether.Methyl perfluoroisobutyl ether is a colourless, clear, and odourless liquid substance. Methyl perfluoro isobutyl ether, also known as perfluoro methyl isobutyl ether, is a fluorinated ether with a highly stable and inert molecular structure due to the presence of fluorine atoms replacing all hydrogen atoms. This chemical exhibits excellent thermal and chemical stability, low viscosity, and unique solvating properties. Due to these properties, it is primarily used as a speciality solvent in the chemical and electronic industries. Additionally, it has applications in refrigeration and as a heat transfer fluid. Its inert nature makes it ideal for environments requiring non-reactive conditions at elevated temperatures and pressures.
使用Methyl perfluoroisobutyl ether is a useful research chemical.
使用Methyl perfluoroisobutyl ether (also known as HFE-7100), a representative product of the Novec series, is a colorless, transparent, low-viscosity, non-flammable liquid with zero ozone depletion potential, low toxicity, and good thermochemical stability, developed by 3M as a substitute for chlorofluorocarbons (CFCs) and hydrochlorofluorocarbon compounds (HCFCs) and used as a green solvent in precision cleaning and in deacidification solutions for paper conservation[2-3]. Methyl perfluorobutyl ether serves as the solvent in which CaMgO2 composite deacidification agents are dispersed, with methyl perfluorododecanoate as a surfactant, to prepare a deacidification suspension[3].
上流・下流製品情報
上流原料
サプライヤー100 社
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
山东泰诚生物科技有限公司18769832557 18769832557 · [email protected]
上海比阳实业有限公司+86-21-52699951; +8613917686115 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [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]
湖北云镁科技有限公司027-59206672 18327059871 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Jinan Langhua Chemical Co.,ltd.+8613220563796 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
武汉市聚舜化工有限公司027-02783261126 18971318572 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
杭州安嘉睿科技有限公司571-89189769 15168342188
上海冷泉生物科技有限公司13918064236 · [email protected]
武汉赛沃尔化工有限公司027-85613400 18707177243 · [email protected]
上海比阳实业有限公司+86-15021878111 · [email protected]
湖北恩星生物科技有限公司16621771607 · [email protected]
石家庄建鑫生物科技有限公司0311-1906231-3169 19062313169 · [email protected]
上氟科技021-65170832 15601903708 · [email protected]
Shanghai Scibiotron Pharmaceutical Co., Ltd+86-16621589600 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
济南朗化化工有限公司0531-85906691 18660816586 · [email protected]
无锡凯福国际贸易有限公司+86-510-82753588 +86-13806194144 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
中山市迪欣化工有限公司19849939632 19849939632 · [email protected]
湖北世腾化工科技有限公司18971850150 19086915685 · [email protected]
Shenzhen Huayi Brothers Technology Co.,Ltd+86-15914124590 · [email protected]
箴德化工科技（上海）有限公司15601952568 · [email protected]
武汉福鑫化工有限公司+86-2759207851; +86-18007136271 · [email protected]
天津康利欣科技有限公司18622939839 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
北京华威锐科化工科技有限公司89508211 18501085097 · [email protected]
石家庄斯迪亚诺精细化工有限公司0311-89250318 031166536426 · [email protected]
湖北阡陌生物科技有限公司0711-3812399 18062309155 · [email protected]
武汉华翔科洁生物技术有限公司027-86638848 18627828293 · [email protected]
湖北鑫杰成化工科技有限公司18008658050 18008658050 · [email protected]
武汉市承天精细化工有限公司18164098996 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
天津汇仁恒通科技有限公司13672008665;18822749002 · [email protected]
成都康巴斯生物科技有限公司18582381569 · [email protected]
浙江诺亚氟化工有限公司13754339091 · [email protected]
盼得（上海）国际贸易有限公司80159919 18662931292 · [email protected]
巴师傅（上海）生物医药科技有限公司60662071 18117346937 · [email protected]
武汉柔博医药化工有限公司027-027-87827088 18986164924 · [email protected]
補足説明
定義本品は、次の化学式で表される有機化合物である。
関連反応
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化合物ノート
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