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Bis(2,2,2-trifluoroethyl) Carbonate

Catalog Number
ACM1513877
Product Name
Bis(2,2,2-trifluoroethyl) Carbonate
Structure
CAS
1513-87-7
Category
Battery Materials
Synonyms
Carbonic Acid Bis(2,2,2-trifluoroethyl) Ester
IUPAC Name
bis(2,2,2-trifluoroethyl) carbonate
Molecular Weight
226.07
Molecular Formula
C5H4F6O3
Canonical SMILES
C(C(F)(F)F)OC(=O)OCC(F)(F)F
InChI
InChI=1S/C5H4F6O3/c6-4(7,8)1-13-3(12)14-2-5(9,10)11/h1-2H2
InChI Key
WLLOZRDOFANZMZ-UHFFFAOYSA-N
Boiling Point
118 °C
Flash Point
11 °C
Purity
>98.0%(GC)
Appearance
Colorless to Almost colorless clear liquid
Complexity
175
Covalently-Bonded Unit Count
1
Exact Mass
226.006463g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.H225 : Highly flammable liquid and vapor.
Heavy Atom Count
14
MDL Number
MFCD11857845
Monoisotopic Mass
226.006463g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P240 : Ground/bond container and receiving equipment.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P233 : Keep container tightly closed.P243 : Take precautionary measures against static discharge.P241 : Use explosion-proof electrical/ ventilating/ lighting/ equipment.P242 : Use only non-sparking tools.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P403 + P235 : Store in a well-ventilated place. Keep cool.
Refractive Index
1.31
Rotatable Bond Count
4
Signal Word
Danger
Specific Gravity
1.51
XLogP3
2.7
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