fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite

C9H15F13O — CID 159599668

IUPACfluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
SMILESC.C.CF.FCC(F)(F)C(F)(F)F.FCC(F)(OF)C(F)(F)F
InChIInChI=1S/C3H2F6O.C3H2F6.CH3F.2CH4/c4-1-2(5,10-9)3(6,7)8;4-1-2(5,6)3(7,8)9;1-2;;/h1H2;1H2;1H3;2*1H4
InChIKeyMLHQSLAKJPSAAR-UHFFFAOYSA-N
MW386.19 g/mol
LogP6.10
Rot. Bonds3

About fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite

fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite (PubChem CID 159599668) has the molecular formula C9H15F13O and a molecular weight of 386.19 g/mol. Its IUPAC name is fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite.

Molecular Properties

Compound Namefluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
PubChem CID159599668
Molecular FormulaC9H15F13O
Molecular Weight386.19 g/mol
Exact Mass386.09
IUPAC Namefluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
SMILESC.C.CF.FCC(F)(F)C(F)(F)F.FCC(F)(OF)C(F)(F)F
InChIInChI=1S/C3H2F6O.C3H2F6.CH3F.2CH4/c4-1-2(5,10-9)3(6,7)8;4-1-2(5,6)3(7,8)9;1-2;;/h1H2;1H2;1H3;2*1H4
InChIKeyMLHQSLAKJPSAAR-UHFFFAOYSA-N
XLogP6.10
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.19
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The IUPAC name of fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite (CID 159599668) is fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite.
What is the SMILES notation for fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The canonical SMILES for fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite is C.C.CF.FCC(F)(F)C(F)(F)F.FCC(F)(OF)C(F)(F)F.
What is the InChIKey of fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The InChIKey is MLHQSLAKJPSAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F6O.C3H2F6.CH3F.2CH4/c4-1-2(5,10-9)3(6,7)8;4-1-2(5,6)3(7,8)9;1-2;;/h1H2;1H2;1H3;2*1H4.
What are the key properties of fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite has a molecular weight of 386.19 g/mol, XLogP of 6.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite is sourced from PubChem (CID 159599668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).