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Molecule
1,1,1,2,2,3,4,5,5,5-Decafluoropentane
CAS: 138495-42-8 · C5H2F10
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 138495-42-8
- Molecular Formula
- C5H2F10
- Molecular Mass
- 252.05 g/mol
Identifiers
CAS Registry Number
138495-42-8
SMILES
FC(C(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChI Key
RIQRGMUSBYGDBL-UHFFFAOYSA-N
InChI
InChI=1S/C5H2F10/c6-1(2(7)4(10,11)12)3(8,9)5(13,14)15/h1-2H
Names and Synonyms
- 1,1,1,2,2,3,4,5,5,5-Decafluoropentane Synonym
- Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro- Synonym
- 1,1,1,2,2,3,4,5,5,5-Decafluoropentane Synonym
- 1,1,1,2,3,4,4,5,5,5-Decafluoropentane Synonym
- R 4310 Synonym
- 2,3-Dihydroperfluoropentane Synonym
- Vertrel XF Synonym
- HFC 43-10mee Synonym
- HFC 43-10 Synonym
- HFC 4310mee Synonym
- Vertrel Synonym
- R-4310meec Synonym
- Verteral Synonym
- 2,3-Dihydrodecafluoropentane Synonym
- 2H,3H-Perfluoropentane Synonym
- 2H,3H-Decafluoropentane Synonym
- Vertrel XY Synonym
- Vertrel FX Synonym
- HFO 4310mfc Synonym
- R 43-10Mee Synonym
- Vetrel Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 252.05 g/mol | CAS Common Chemistry |
| 252.05099999999996 g/mol | RDKit | |
| 252.051 g/mol | RDKit | |
| Density | 1.60 g/cm³ | CAS Common Chemistry |
| 1.600 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | FC(C(F)C(F)(F)C(F)(F)F)C(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/C5H2F10/c6-1(2(7)4(10,11)12)3(8,9)5(13,14)15/h1-2H | CAS Common Chemistry |
| InChI Key | InChIKey=RIQRGMUSBYGDBL-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 1,1,1,2,2,3,4,5,5,5-Decafluoropentane | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.4225000000000003 | RDKit |
| 3.4225 | RDKit | |
| Molar Refractivity | 26.849 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 251.999682264 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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140
120
100
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 252.05 g/mol; density = 1.600 g/mL. Edit any field — others recompute live.