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Molecule
ID:6504
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₃H₂F₆
Molecular Mass
152.0383992
Exact Mass
152.00606938
Charge
0
InChI
InChI=1S/C3H2F6/c4-2(5,6)1-3(7,8)9/h1H2
InChIKey
NSGXIBWMJZWTPY-UHFFFAOYSA-N
Canonic Smiles
FC(CC(F)(F)F)(F)F
Isomeric Smiles
FC(F)(CC(F)(F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.1331947
LogD (pH = 7.4)
2.1331947
Log P
2.1331947
Molar Refractivity
17.321
Polarizability
6.3192186
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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Related Proteins
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Bioactivity
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Data Source
Commercial Catalog
Matrix Scientific
001189
Apollo Scientific
PC4788
Academic Data
Wikipedia
1,1,1,3,3,3-Hexafluoropropane
PubChem
12722
Names and Identifiers
Synonyms
2H,2H-Perfluoropropane (FC-236fa) 97%
1,1,1,3,3,3-Hexafluoropropane (FC-236fa)
1,1,1,3,3,3-Hexafluoropropane
FC-236fa
FE 36
R 236fa
bistrifluoromethylmethane
2,2-dihydroperfluoropropane
CCO610;HCFC 236fa
FE-36
HFC-236fa
IUPAC Traditional name
1,1,1,3,3,3-hexafluoropropane
IUPAC name
1,1,1,3,3,3-hexafluoropropane
Registration numbers
CAS Number
690-39-1
MDL Number
MFCD00069116
PubChem SID
160969811
Wikipedia Title
1,1,1,3,3,3-Hexafluoropropane
PubChem CID
12722
EC Number
425-320-1
Chemspider ID
12199
Molecule Details
Apollo Scientific
PC4788
Cylinder - 1/4" NPT connection
Wikipedia
1,1,1,3,3,3-Hexafluoropropane
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Registration numbers
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CAS Number
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MDL Number
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PubChem SID
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Wikipedia Title
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PubChem CID
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EC Number
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Chemspider ID
Properties
Safety Information
Storage Warning
GAS
Source
TSCA Listed
false
Source
MSDS Link
Download link
Source
Main Hazard
asphyxiant
Source
Safety Statements
S
38
Source
RTECS
TZ4043332
Source
Physical Property
Boiling Point
-1.1°C
Source
-1.4 to -0.7 °C
Source
Flash Point
Non-flammable
Source
Solubility
724 mg/l in water
Source
Vapor Pressure
270 kPa at 25 °C
Source
Melting Point
-98.0 to -93.6 °C
Source
mol.kg
-1
.bar
-1
Source
Colorless gas
Source
Product Information
Purity
98%
Source
Henry Constant
Apperance