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Molecule
ID:128875
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₄F₈
Molecular Mass
200.0300256
Exact Mass
199.98722576
Charge
0
InChI
InChI=1S/C4F8/c5-2(6)1(3(7,8)9)4(10,11)12
InChIKey
DAFIBNSJXIGBQB-UHFFFAOYSA-N
Canonic Smiles
FC(=C(C(F)(F)F)C(F)(F)F)F
Isomeric Smiles
C(=C(F)F)(C(F)(F)F)C(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6448092
LogD (pH = 7.4)
2.6448092
Log P
2.6448092
Molar Refractivity
32.9259
Polarizability
7.9991937
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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Perfluoroisobutene
PubChem
61109
Names and Identifiers
IUPAC Traditional name
perfluoroisobutylene
Synonyms
Octafluoro-sec-butene
Perfluoroisobutylene
Perfluoroisobutene
PFIB
Perfluoroisobutene
Octafluoroisobutylene
IUPAC name
1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene
Registration numbers
CAS Number
382-21-8
Wikipedia Title
Perfluoroisobutene
PubChem CID
61109
PubChem SID
162223178
Properties
Physical Property
Density
8.2 g/l
Source
Boiling Point
7.0 °C (280 K)
Source
Safety Information
RTECS
UD1800000
Source
Molecule Details
Wikipedia
Perfluoroisobutene
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay