deuterio(fluoro)methane;methane

C4H15F — CID 158756450

IUPACdeuterio(fluoro)methane;methane
SMILESC.C.C.[2H]CF
InChIInChI=1S/CH3F.3CH4/c1-2;;;/h1H3;3*1H4/i1D;;;
InChIKeyIODFTSNJINPBDT-JAMWHWASSA-N
MW83.17 g/mol
LogP2.49
Rot. Bonds

About deuterio(fluoro)methane;methane

deuterio(fluoro)methane;methane (PubChem CID 158756450) has the molecular formula C4H15F and a molecular weight of 83.17 g/mol. Its IUPAC name is deuterio(fluoro)methane;methane.

Molecular Properties

Compound Namedeuterio(fluoro)methane;methane
PubChem CID158756450
Molecular FormulaC4H15F
Molecular Weight83.17 g/mol
Exact Mass83.12
IUPAC Namedeuterio(fluoro)methane;methane
SMILESC.C.C.[2H]CF
InChIInChI=1S/CH3F.3CH4/c1-2;;;/h1H3;3*1H4/i1D;;;
InChIKeyIODFTSNJINPBDT-JAMWHWASSA-N
XLogP2.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.17
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Fluoromethyl(trimethyl)stannane
CID 21766732
Deuterio(fluoro)methane;methane
CID 158011121
Fluoromethane;methane
CID 158011122
Fluoromethane;fluoro(tritio)methane;methane
CID 158510284
Fluoromethane;methane
CID 160601066
Fluoromethane;methane;tritium monohydride
CID 161704736
Fluoromethane;methane;molecular hydrogen
CID 161704737
Fluoromethane;methane
CID 175978933

Frequently Asked Questions

What is the IUPAC name of deuterio(fluoro)methane;methane?
The IUPAC name of deuterio(fluoro)methane;methane (CID 158756450) is deuterio(fluoro)methane;methane.
What is the SMILES notation for deuterio(fluoro)methane;methane?
The canonical SMILES for deuterio(fluoro)methane;methane is C.C.C.[2H]CF.
What is the InChIKey of deuterio(fluoro)methane;methane?
The InChIKey is IODFTSNJINPBDT-JAMWHWASSA-N. The full InChI is InChI=1S/CH3F.3CH4/c1-2;;;/h1H3;3*1H4/i1D;;;.
What are the key properties of deuterio(fluoro)methane;methane?
deuterio(fluoro)methane;methane has a molecular weight of 83.17 g/mol, XLogP of 2.49, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for deuterio(fluoro)methane;methane is sourced from PubChem (CID 158756450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).