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Methyl perfluoroisobutyl ether

HCID 4156734
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Grundinformationen

CAS
163702-08-7
Standard-SMILES
COC(F)(F)C(F)(C(F)(F)F)C(F)(F)F
InChIKey
DJXNLVJQMJNEMN-UHFFFAOYSA-N
Summenformel
C5H3F9O
Durchschnittliche Molmasse
250,06 g/mol
Monoisotopische Masse
250,0040187

Überblick

See also: Glycerin; methyl perfluoroisobutyl ether (component of).

Namen und Bezeichner

Bevorzugter Name
Methyl perfluoroisobutyl ether
IUPAC
2-[difluoro(methoxy)methyl]-1,1,1,2,3,3,3-heptafluoropropane
Englischer Name
Methyl perfluoroisobutyl ether
Summenformel
C5H3F9O
Molmasse
250.06

Namen und Synonyme

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
Weitere Namen anzeigen
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

Datenbank-Bezeichner

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,3
Polarare Oberfläche (TPSA)
9,2 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
10
Frei drehbare Bindungen
2
Schwere Atome
15
Formalladung
0
Komplexität
212

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Ethers
PFAS · 5 Einträge

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 · 2 Einträge

Liquid

Clear colorless liquid with a mild ethereal odor; [3M MSDS]

Physikochemische Eigenschaften

Siedepunkt
20 · 20.0±40.0℃ (760 Torr)
Dichte
1.5 · 1.500±0.06 g/cm3 (20 ºC 760 Torr)
Flammpunkt
-29.6 · -29.6±23.2℃
Kosmetik-Inhaltsstoffe Funktionen
SOLVENTVISCOSITY CONTROLLING
InChI
InChI=1S/C5H3F9O/c6-2(7)15-1-3(8,4(9,10)11)5(12,13)14/h2H,1H2

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 6 Einträge

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.

Gefahrenhinweise

Regulatory Information · 5 Einträge

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 · 1 Eintrag

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]

Chemie und Industrie

Verwendung und Herstellung

Uses · 4 Einträge

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 · 2 Einträge

Computer and Electronic Product Manufacturing

Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro-: ACTIVE

Anwendungen · 3 Einträge

BeschreibungMethyl 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.

VerwendenMethyl perfluoroisobutyl ether is a useful research chemical.

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Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
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
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 Datenbank
163702 · 163702-08-7
EPA chemische Informationen
2 · Propane, 2-(difluoromethoxymethyl)-1,1,1,2,3,3,3-heptafluoro- (163702-08-7)
Hazard Classes and Categories · 2 Einträge

Aquatic Chronic 4 (10%)

Acute Tox. 4 (19.8%)

Toxikologische Informationen

Adverse EffectsNeurotoxin - Acute solvent syndrome

Sicherheitsdaten

tsca
TSCA listed

VerwendenMethyl 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].

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

1-METHOXY-(PERFLUORO-2-METHYL-1-PROPENE)PERFLUORO(2-METHYLPROPANOYL)FLUORIDEDimethyl ether

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