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2,2,2-Trifluoroethyl difluoromethyl ether

HCID 74668
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1885-48-9
Standard SMILES
FC(F)OCC(F)(F)F
InChIKey
ZASBKNPRLPFSCA-UHFFFAOYSA-N
Molecular formula
C3H3F5O
Average molar mass
150.05 g/mol
Monoisotopic mass
150.01040553

Overview

*Ethers

Names & identifiers

Preferred name
2,2,2-Trifluoroethyl difluoromethyl ether
IUPAC
2-(difluoromethoxy)-1,1,1-trifluoroethane
English name
Difluoromethyl 2,2,2-trifluoroethyl ether
Molecular formula
C3H3F5O
Molecular weight
150.05

Names & synonyms

1885-48-9Difluoromethyl 2,2,2-trifluoroethyl ether2-(Difluoromethoxy)-1,1,1-trifluoroethane2,2,2-Trifluoroethyl difluoromethyl etherHFE-245MFHFE-245fa2986WJ01025DTXSID5073951HFC-E-245R-E-245FA1E-245DFM-TFE
Show more names
DAIKIN T-1114Isoflurane Impurity 2Isofluorane Impurity 2butyl(3-hydroxybutyl)tinIsoflurane Related CoMpound BIsoflurane USP Related Compound B2,2,2-trifluoroethyl difluoromethy ether
RefChem:84672DTXCID0035954413-830-7Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro-Isoflurane EP Impurity BMFCD00153127UNII-986WJ01025Isoflurane Imp. B (EP); Isoflurane USP Related Compound B; Isoflurane USP RC B; 2-(Difluoromethoxy)-1,1,1-trifluoroethane

Database identifiers

CAS
1885-48-9
PubChem CID
74668
DTXSID
DTXSID5073951

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
9
Formal charge
0
Complexity
76.8

Experimental & physicochemical properties

PFASPFAS -> PFAS identified in REACH Regulation EC No. 1272/2008
SpringerMaterials PropertiesViscosity
Physical DescriptionLiquid

Physicochemical properties

Melting point
-23.15 °C · -23.15°C
Boiling point
28 · 28-30°C
Density
1.4783 · 1.4783 (estimate)
refractive index
1.3543 · 1.3543 (estimate)
storage temp.
2 · 2-8°C
solubility
Acetone (Slightly), Chloroform (Soluble), DMSO (Slightly), Methanol (Soluble)
form
liquid
Stability
Volatile
Major Application
pharmaceutical
InChI
1S/C3H3F5O/c4-2(5)9-1-3(6,7)8/h2H,1H2

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, 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.

Hazard information

Regulatory Information · 3 items

Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro- 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.

REACH registered substance: 2-(Difluoromethoxy)-1,1,1-trifluoroethane (EC: 413-830-7)

Hazard Classes and CategoriesSkin Irrit. 2 (50%)

Safety data

wgk
WGK 3
tsca
TSCA listed
ridadr
1993
hs_code
2909191800
risk_code
10-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 250,000 - <550,000 lb
Industry UsesIntermediate
General Manufacturing Information · 2 items

Pharmaceutical and Medicine Manufacturing

Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro-: ACTIVE

Applications

UsesDifluoromethyl 2,2,2-Trifluoroethyl Ether can be used as a secondary battery separator layer, electrode structure, and secondary battery.

Upstream & downstream products

Downstream products

Ethane, pentafluoro(trifluoromethoxy)-1,1-Dichloro-2,2,2-trifluoroethyl chlorodifluoromethyl ethercompound 485

Suppliers33 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
常州新氟化学有限公司0519-85528066; 13275212658 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

Related reactions

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New reaction record

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
UNII
986WJ01025
EC Number
413-830-7、642-359-1
Nikkaji
J668.547A
InChIKey
ZASBKNPRLPFSCA-UHFFFAOYSA-N
SMILES
FC(F)(F)COC(F)F
CAS DataBase Reference
1885 · 1885-48-9(CAS DataBase Reference)
FDA UNII
986 WJ01025 · 986WJ01025
EPA Substance Registry System
2 · Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro- (1885-48-9)
UNSPSC Code
41116107 · 41116107
NACRES
24 · NA.24
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
336 · H336
Precautionary statements
261 · P261-P271-P304+P340+P312-P403+P233-P405-P501
target organs
Central nervous system
Hazard Codes
Xi
Risk Statements
10 · 10-36/37/38
Safety Statements
26 · 26-36/37/39
RIDADR
1993 · 1993
WGK Germany
3 · WGK 3
TSCA
TSCA listed
HazardClass
IRRITANT
HS Code
2909191800 · 2909191800
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
3 · STOT SE 3
REACH Registrations
Inactive
26-36/37/39
hazard_class
IRRITANT
Storage Class
10 - Combustible liquids
target organs
Central nervous system
Hazard statements
H336
REACH Registrations
Inactive
Hazard Classifications
STOT SE 3
Precautionary statements
P261-P271-P304+P340+P312-P403+P233-P405-P501
孟成科技(上海)有限公司
400-820-6829 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
韶关名图化工有限公司13411131983 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
湖南秉航新材料有限公司85521272 18932438858 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南通众合化工新材料有限公司0513-85666561 15950816326 · [email protected]