2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)

C25H47F12O14Rf3-3 — CID 162080460

IUPAC2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)
SMILESCCC(O)COCC(O)(F)F.COC[C-](F)F.OC(COCCF)COC[C-](F)F.OCCOCC(O)COCC(O)(F)F.OC[C-](F)F.OF.[Rf].[Rf].[Rf]
InChIInChI=1S/C7H12F3O3.C7H14F2O5.C6H12F2O3.C3H5F2O.C2H3F2O.FHO.3Rf/c8-1-2-12-3-6(11)4-13-5-7(9)10;8-7(9,12)5-14-4-6(11)3-13-2-1-10;1-2-5(9)3-11-4-6(7,8)10;1-6-2-3(4)5;3-2(4)1-5;1-2;;;/h6,11H,1-5H2;6,10-12H,1-5H2;5,9-10H,2-4H2,1H3;2H2,1H3;5H,1H2;2H;;;/q-1;;;2*-1;;;;
InChIKeyODPCMIJONLZPST-UHFFFAOYSA-N
MW1600.61 g/mol
LogP1.43
Rot. Bonds24

About 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)

2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) (PubChem CID 162080460) has the molecular formula C25H47F12O14Rf3-3 and a molecular weight of 1600.61 g/mol. Its IUPAC name is 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium).

Molecular Properties

Compound Name2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)
PubChem CID162080460
Molecular FormulaC25H47F12O14Rf3-3
Molecular Weight1600.61 g/mol
Exact Mass1600.64
IUPAC Name2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)
SMILESCCC(O)COCC(O)(F)F.COC[C-](F)F.OC(COCCF)COC[C-](F)F.OCCOCC(O)COCC(O)(F)F.OC[C-](F)F.OF.[Rf].[Rf].[Rf]
InChIInChI=1S/C7H12F3O3.C7H14F2O5.C6H12F2O3.C3H5F2O.C2H3F2O.FHO.3Rf/c8-1-2-12-3-6(11)4-13-5-7(9)10;8-7(9,12)5-14-4-6(11)3-13-2-1-10;1-2-5(9)3-11-4-6(7,8)10;1-6-2-3(4)5;3-2(4)1-5;1-2;;;/h6,11H,1-5H2;6,10-12H,1-5H2;5,9-10H,2-4H2,1H3;2H2,1H3;5H,1H2;2H;;;/q-1;;;2*-1;;;;
InChIKeyODPCMIJONLZPST-UHFFFAOYSA-N
XLogP1.43
TPSA217.22 Ų
H-Bond Donors8
H-Bond Acceptors14
Rotatable Bonds24
Heavy Atoms54
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001600.61
LogP ≤ 51.43
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) with MolForge

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Related Compounds

1-(2,2-difluoroethoxy)butan-2-ol;hypofluorous acid;rutherfordium
CID 154623566
1-(2-fluoroethoxy)butan-2-ol
CID 58952834
2,2-difluoro-2-(fluoromethoxy)ethanol;1-(2-fluoroethoxy)-3-methoxypropan-2-ol;bis(1,1,2,2-tetrafluoroethene)
CID 161291709
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-3-methoxypropan-2-ol
CID 88655335
1-(2-hydroxyethoxy)butan-2-ol;phosphoric acid
CID 175300111
1-[2-[[2-[2-[3-[2-[1,1-difluoro-2-(2-methoxyethoxy)ethoxy]-2,2-difluoroethoxy]-2-hydroxypropoxy]-1,1-difluoroethoxy]-2,2-difluoroethoxy]methoxy]ethoxy]-3-(2-hydroxyethoxy)propan-2-ol
CID 157172229
1-(2-methoxyethoxy)butan-2-ol
CID 20514540
1-(2,2-difluoroethoxy)-3-(2,2-difluoro-2-hydroxyethoxy)propan-2-ol
CID 154623548
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-ol
CID 104564611
1-[2-[2-[2-(2-hydroxybutoxy)ethoxy]ethoxy]ethoxy]butan-2-ol
CID 12645981
1-(2-amino-2-methylpropoxy)butan-2-ol
CID 106939915
1-(2-hydroxyethoxy)butan-2-ol;prop-2-enoic acid
CID 87077863

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)?
The IUPAC name of 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) (CID 162080460) is 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium).
What is the SMILES notation for 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)?
The canonical SMILES for 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) is CCC(O)COCC(O)(F)F.COC[C-](F)F.OC(COCCF)COC[C-](F)F.OCCOCC(O)COCC(O)(F)F.OC[C-](F)F.OF.[Rf].[Rf].[Rf].
What is the InChIKey of 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)?
The InChIKey is ODPCMIJONLZPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3O3.C7H14F2O5.C6H12F2O3.C3H5F2O.C2H3F2O.FHO.3Rf/c8-1-2-12-3-6(11)4-13-5-7(9)10;8-7(9,12)5-14-4-6(11)3-13-2-1-10;1-2-5(9)3-11-4-6(7,8)10;1-6-2-3(4)5;3-2(4)1-5;1-2;;;/h6,11H,1-5H2;6,10-12H,1-5H2;5,9-10H,2-4H2,1H3;2H2,1H3;5H,1H2;2H;;;/q-1;;;2*-1;;;;.
What are the key properties of 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium)?
2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) has a molecular weight of 1600.61 g/mol, XLogP of 1.43, 24 rotatable bonds, 8 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoroethanol;1-(2,2-difluoroethoxy)-3-(2-fluoroethoxy)propan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)butan-2-ol;1-(2,2-difluoro-2-hydroxyethoxy)-3-(2-hydroxyethoxy)propan-2-ol;1,1-difluoro-2-methoxyethane;hypofluorous acid;tris(rutherfordium) is sourced from PubChem (CID 162080460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).