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Molecule
ID:99870
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₃H₅F₃
Molecular Mass
98.0670096
Exact Mass
98.03433482
Charge
0
InChI
InChI=1S/C3H5F3/c4-2-1-3(5)6/h3H,1-2H2
InChIKey
GQSMEOJGQJMOHA-UHFFFAOYSA-N
Canonic Smiles
FCCC(F)F
Isomeric Smiles
FC(CCF)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.1091536
LogD (pH = 7.4)
1.1091536
Log P
1.1091536
Molar Refractivity
15.5814
Polarizability
5.9096813
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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Bioactivity
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General Information
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IUPAC name
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IUPAC Traditional name
Registration numbers
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CAS Number
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MDL Number
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PubChem SID
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PubChem CID
Properties
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Physical Property
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Safety Information
Related Proteins
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Molecule Details
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
Apollo Scientific
PC7926
Academic Data
PubChem
12927177
Names and Identifiers
Synonyms
1,1,3-Trifluoropropane 97%
IUPAC name
1,1,3-trifluoropropane
IUPAC Traditional name
1,1,3-trifluoropropane
Registration numbers
CAS Number
24270-67-5
MDL Number
MFCD07784186
PubChem SID
162086117
PubChem CID
12927177
Properties
Physical Property
Density
1.182
Source
Boiling Point
45°C
Source
Refractive Index
1.309
Source
Safety Information
Storage Warning
Flammable
Source
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay