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Molecule
ID:9121
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₆Cl₂F₁₀
Molecular Mass
332.954232
Exact Mass
331.92173756
Charge
0
InChI
InChI=1S/C6Cl2F10/c7-1(9)2(8,10)4(13,14)6(17,18)5(15,16)3(1,11)12
InChIKey
IESCLXSTSQIECY-UHFFFAOYSA-N
Canonic Smiles
FC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)Cl)(F)Cl
Isomeric Smiles
C1(C(C(C(C(C1(F)F)(Cl)F)(F)Cl)(F)F)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.0707107
LogD (pH = 7.4)
5.0707107
Log P
5.0707107
Molar Refractivity
37.845
Polarizability
15.046248
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
false
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
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Data Source
Commercial Catalog
Apollo Scientific
PC8574
Matrix Scientific
005261
Academic Data
PubChem
2773999
Names and Identifiers
Synonyms
1,2-Dichlorodecafluorocyclohexane
IUPAC Traditional name
1,2-dichloro-1,2,3,3,4,4,5,5,6,6-decafluorocyclohexane
IUPAC name
1,2-dichloro-1,2,3,3,4,4,5,5,6,6-decafluorocyclohexane
Registration numbers
MDL Number
MFCD01862047
CAS Number
336-14-1
PubChem CID
2773999
PubChem SID
160972428
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Properties
Safety Information
TSCA Listed
false
Source
MSDS Link
Download link
Source
Storage Warning
Irritant
Source
Physical Property
Boiling Point
108°C
Source
Melting Point
32-34°C
Source
none°C
Source
Flash Point