1,1-difluoro-2-nitrosoethane

C2H3F2NO — CID 162620919

IUPAC1,1-difluoro-2-nitrosoethane
SMILESO=NCC(F)F
InChIInChI=1S/C2H3F2NO/c3-2(4)1-5-6/h2H,1H2
InChIKeyXLNCXVIBKRBVEG-UHFFFAOYSA-N
MW95.05 g/mol
LogP1.02
Rot. Bonds2

About 1,1-difluoro-2-nitrosoethane

1,1-difluoro-2-nitrosoethane (PubChem CID 162620919) has the molecular formula C2H3F2NO and a molecular weight of 95.05 g/mol. Its IUPAC name is 1,1-difluoro-2-nitrosoethane.

Molecular Properties

Compound Name1,1-difluoro-2-nitrosoethane
PubChem CID162620919
Molecular FormulaC2H3F2NO
Molecular Weight95.05 g/mol
Exact Mass95.02
IUPAC Name1,1-difluoro-2-nitrosoethane
SMILESO=NCC(F)F
InChIInChI=1S/C2H3F2NO/c3-2(4)1-5-6/h2H,1H2
InChIKeyXLNCXVIBKRBVEG-UHFFFAOYSA-N
XLogP1.02
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.05
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-nitrosoethane?
The IUPAC name of 1,1-difluoro-2-nitrosoethane (CID 162620919) is 1,1-difluoro-2-nitrosoethane.
What is the SMILES notation for 1,1-difluoro-2-nitrosoethane?
The canonical SMILES for 1,1-difluoro-2-nitrosoethane is O=NCC(F)F.
What is the InChIKey of 1,1-difluoro-2-nitrosoethane?
The InChIKey is XLNCXVIBKRBVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3F2NO/c3-2(4)1-5-6/h2H,1H2.
What are the key properties of 1,1-difluoro-2-nitrosoethane?
1,1-difluoro-2-nitrosoethane has a molecular weight of 95.05 g/mol, XLogP of 1.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-nitrosoethane is sourced from PubChem (CID 162620919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).