N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane

C8H15F12NO — CID 91590576

IUPACN,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane
SMILESCF.FCC(F)(F)F.FCF.FCN(F)CF.FCOCF
InChIInChI=1S/C2H2F4.C2H4F3N.C2H4F2O.CH2F2.CH3F/c3-1-2(4,5)6;3-1-6(5)2-4;3-1-5-2-4;2-1-3;1-2/h1H2;1-2H2;1-2H2;1H2;1H3
InChIKeyHIBIEKGWOKPPIF-UHFFFAOYSA-N
MW369.19 g/mol
LogP4.87
Rot. Bonds4

About N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane

N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane (PubChem CID 91590576) has the molecular formula C8H15F12NO and a molecular weight of 369.19 g/mol. Its IUPAC name is N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane.

Molecular Properties

Compound NameN,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane
PubChem CID91590576
Molecular FormulaC8H15F12NO
Molecular Weight369.19 g/mol
Exact Mass369.10
IUPAC NameN,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane
SMILESCF.FCC(F)(F)F.FCF.FCN(F)CF.FCOCF
InChIInChI=1S/C2H2F4.C2H4F3N.C2H4F2O.CH2F2.CH3F/c3-1-2(4,5)6;3-1-6(5)2-4;3-1-5-2-4;2-1-3;1-2/h1H2;1-2H2;1-2H2;1H2;1H3
InChIKeyHIBIEKGWOKPPIF-UHFFFAOYSA-N
XLogP4.87
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.19
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

1,1,1,2-tetrafluoroethane;hydrate
CID 87179187
methoxymethane;1,1,1,2,2-pentafluoropropane;1,1,1,2-tetrafluoroethane
CID 158386104
1,2-difluoro-2-(fluoromethoxymethyl)butane
CID 58587214
1-[2-(fluoromethoxy)ethoxy]-2-[2-[2-(fluoromethoxy)ethoxy]ethoxy]ethane
CID 11021545
2-(fluoromethoxymethyl)-2-methylpropane-1,3-diol;2-methyl-2-(2,2,2-trifluoroethoxymethyl)propane-1,3-diol;tetrafluoromethane
CID 159500657
bis(difluoromethane);1,3-difluoropropane;fluoroethane;fluoromethane;fluoromethyl hypofluorite;methane;sulfurofluoridic acid;1,1,1,2-tetrafluoroethane
CID 160875126
fluoromethane;fluoro(methoxy)methane;methane;1,1,1-trifluoro-2-methoxyethane
CID 157192080
1,1-difluoro-2-(fluoromethoxy)-1-methoxyethane
CID 59991528
CID 173032522
CID 173032522
N,N,1,1,2,2,3-heptafluoropropan-1-amine
CID 130266790
fluoromethane;1,1,2-trifluoro-1-(fluoromethoxy)ethane;1,2,2-trifluoropropane
CID 91351347
[1,1-dideuterio-2-(fluoromethoxy)ethyl]-trimethylazanium
CID 123795704

Frequently Asked Questions

What is the IUPAC name of N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane?
The IUPAC name of N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane (CID 91590576) is N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane.
What is the SMILES notation for N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane?
The canonical SMILES for N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane is CF.FCC(F)(F)F.FCF.FCN(F)CF.FCOCF.
What is the InChIKey of N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane?
The InChIKey is HIBIEKGWOKPPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2F4.C2H4F3N.C2H4F2O.CH2F2.CH3F/c3-1-2(4,5)6;3-1-6(5)2-4;3-1-5-2-4;2-1-3;1-2/h1H2;1-2H2;1-2H2;1H2;1H3.
What are the key properties of N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane?
N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane has a molecular weight of 369.19 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-difluoro-N-(fluoromethyl)methanamine;difluoromethane;fluoro(fluoromethoxy)methane;fluoromethane;1,1,1,2-tetrafluoroethane is sourced from PubChem (CID 91590576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).