2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane

C13H32F4O — CID 165044243

IUPAC2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane
SMILESCC(C)F.CC(F)(F)F.CCC.CCC.COC
InChIInChI=1S/C3H7F.2C3H8.C2H3F3.C2H6O/c1-3(2)4;2*1-3-2;1-2(3,4)5;1-3-2/h3H,1-2H3;2*3H2,1-2H3;1H3;1-2H3
InChIKeyOQABSSULMODDKS-UHFFFAOYSA-N
MW280.39 g/mol
LogP6.03
Rot. Bonds

About 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane

2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane (PubChem CID 165044243) has the molecular formula C13H32F4O and a molecular weight of 280.39 g/mol. Its IUPAC name is 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane.

Molecular Properties

Compound Name2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane
PubChem CID165044243
Molecular FormulaC13H32F4O
Molecular Weight280.39 g/mol
Exact Mass280.24
IUPAC Name2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane
SMILESCC(C)F.CC(F)(F)F.CCC.CCC.COC
InChIInChI=1S/C3H7F.2C3H8.C2H3F3.C2H6O/c1-3(2)4;2*1-3-2;1-2(3,4)5;1-3-2/h3H,1-2H3;2*3H2,1-2H3;1H3;1-2H3
InChIKeyOQABSSULMODDKS-UHFFFAOYSA-N
XLogP6.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.39
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1,1-trifluoroethane;1,1,2-trifluoroethane
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methyl 2-methylbutanoate;1,1,1-trifluoroethane
CID 91439197
1,1,1-trifluoroethane
CID 9868
1,1,1-trifluoroethane
CID 91327996
1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methane;methoxymethane;propane;propan-2-one
CID 160787315
2-methylhexane;1,1,1-trifluoroethane
CID 157031744
1-(1,1-difluoroethoxy)-2-fluoropropane
CID 175617747
3-ethyl-1,1,1-trifluoro-2,4-dimethylpentane
CID 166136871
difluoro(methoxy)methane;methoxymethane;trifluoro(methoxy)methane
CID 158880331
(3S)-2,2-difluoro-3-methylpentane
CID 129370790
1,1,1-trifluoroethane trichloride
CID 159910186
methoxymethane;1,1,1,2,2-pentafluoropropane;1,1,1,2-tetrafluoroethane
CID 158386104

Frequently Asked Questions

What is the IUPAC name of 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane?
The IUPAC name of 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane (CID 165044243) is 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane.
What is the SMILES notation for 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane?
The canonical SMILES for 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane is CC(C)F.CC(F)(F)F.CCC.CCC.COC.
What is the InChIKey of 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane?
The InChIKey is OQABSSULMODDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F.2C3H8.C2H3F3.C2H6O/c1-3(2)4;2*1-3-2;1-2(3,4)5;1-3-2/h3H,1-2H3;2*3H2,1-2H3;1H3;1-2H3.
What are the key properties of 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane?
2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane has a molecular weight of 280.39 g/mol, XLogP of 6.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropropane;methoxymethane;propane;1,1,1-trifluoroethane is sourced from PubChem (CID 165044243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).