2,2-difluoropropanedinitrile

C3F2N2 — CID 71375051

IUPAC2,2-difluoropropanedinitrile
SMILESN#CC(F)(F)C#N
InChIInChI=1S/C3F2N2/c4-3(5,1-6)2-7
InChIKeyXWRISGYTPCBGDC-UHFFFAOYSA-N
MW102.04 g/mol
LogP0.67
Rot. Bonds

About 2,2-difluoropropanedinitrile

2,2-difluoropropanedinitrile (PubChem CID 71375051) has the molecular formula C3F2N2 and a molecular weight of 102.04 g/mol. Its IUPAC name is 2,2-difluoropropanedinitrile.

Molecular Properties

Compound Name2,2-difluoropropanedinitrile
PubChem CID71375051
Molecular FormulaC3F2N2
Molecular Weight102.04 g/mol
Exact Mass102.00
IUPAC Name2,2-difluoropropanedinitrile
SMILESN#CC(F)(F)C#N
InChIInChI=1S/C3F2N2/c4-3(5,1-6)2-7
InChIKeyXWRISGYTPCBGDC-UHFFFAOYSA-N
XLogP0.67
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.04
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

fluoromethanetricarbonitrile
CID 71372556
2-fluoro-2-methylpropanenitrile
CID 10129896
2-bromo-2-fluoropropanedinitrile
CID 134872272
2,3,3-trifluoro-2,3-dihydroxypropanenitrile
CID 89493255
2-(2-fluoropropan-2-yl)-2-hydroxypropanedinitrile
CID 10796849
2,2-difluoro-2-nitroacetonitrile
CID 12695934
(2S)-3,3,3-trifluoro-2-hydroxy-2-methylpropanenitrile
CID 10285802
2-(1-cyano-1-fluoroprop-2-enoxy)-2-fluorobut-3-enenitrile
CID 87334450
2,3-bis(difluoroamino)-2,3,3-trifluoropropanenitrile
CID 150973529
2,3-dichloro-3-[(1,2-dichloro-2-cyano-1,2-difluoroethyl)disulfanyl]-2,3-difluoropropanenitrile
CID 594030
2,2-difluoro-3-oxobutanenitrile
CID 141364728
cyano-tris(trifluoromethyl)boranuide
CID 87174075

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoropropanedinitrile?
The IUPAC name of 2,2-difluoropropanedinitrile (CID 71375051) is 2,2-difluoropropanedinitrile.
What is the SMILES notation for 2,2-difluoropropanedinitrile?
The canonical SMILES for 2,2-difluoropropanedinitrile is N#CC(F)(F)C#N.
What is the InChIKey of 2,2-difluoropropanedinitrile?
The InChIKey is XWRISGYTPCBGDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F2N2/c4-3(5,1-6)2-7.
What are the key properties of 2,2-difluoropropanedinitrile?
2,2-difluoropropanedinitrile has a molecular weight of 102.04 g/mol, XLogP of 0.67, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoropropanedinitrile is sourced from PubChem (CID 71375051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).