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124898-13-1 molecular structure
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trimethyl(pentafluoroethyl)silane

ChemBase ID: 94078
Molecular Formular: C5H9F5Si
Molecular Mass: 192.202476
Monoisotopic Mass: 192.03936792
SMILES and InChIs

SMILES:
[Si](C)(C)(C(C(F)(F)F)(F)F)C
Canonical SMILES:
FC(C(F)(F)F)([Si](C)(C)C)F
InChI:
InChI=1S/C5H9F5Si/c1-11(2,3)5(9,10)4(6,7)8/h1-3H3
InChIKey:
MTPVUVINMAGMJL-UHFFFAOYSA-N

Cite this record

CBID:94078 http://www.chembase.cn/molecule-94078.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trimethyl(pentafluoroethyl)silane
IUPAC Traditional name
trimethyl(pentafluoroethyl)silane
Synonyms
(Pentafluoroethyl)trimethylsilane
(Pentafluoroethyl)trimethylsilane 97%
(五氟乙基)三甲基硅烷
CAS Number
124898-13-1
MDL Number
MFCD04116436
PubChem SID
162080733
PubChem CID
2760820

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 2760820 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.7526  LogD (pH = 7.4) 3.7526 
Log P 3.7526  Molar Refractivity 28.412 cm3
Polarizability 12.284846 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Refractive Index
1.3270 expand Show data source
Storage Warning
Flammable/Irritant expand Show data source
Moisture Sensitive expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN1993 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
II expand Show data source
Risk Statements
11-36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H224-H315-H319-H335 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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