1,1-difluoroethane

C2H3F2- — CID 102066194

IUPAC1,1-difluoroethane
SMILES[CH2-]C(F)F
InChIInChI=1S/C2H3F2/c1-2(3)4/h2H,1H2/q-1
InChIKeyUOWLLWPMHAKICQ-UHFFFAOYSA-N
MW65.04 g/mol
LogP1.09
Rot. Bonds

About 1,1-difluoroethane

1,1-difluoroethane (PubChem CID 102066194) has the molecular formula C2H3F2- and a molecular weight of 65.04 g/mol. Its IUPAC name is 1,1-difluoroethane.

Molecular Properties

Compound Name1,1-difluoroethane
PubChem CID102066194
Molecular FormulaC2H3F2-
Molecular Weight65.04 g/mol
Exact Mass65.02
IUPAC Name1,1-difluoroethane
SMILES[CH2-]C(F)F
InChIInChI=1S/C2H3F2/c1-2(3)4/h2H,1H2/q-1
InChIKeyUOWLLWPMHAKICQ-UHFFFAOYSA-N
XLogP1.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50065.04
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoroethane?
The IUPAC name of 1,1-difluoroethane (CID 102066194) is 1,1-difluoroethane.
What is the SMILES notation for 1,1-difluoroethane?
The canonical SMILES for 1,1-difluoroethane is [CH2-]C(F)F.
What is the InChIKey of 1,1-difluoroethane?
The InChIKey is UOWLLWPMHAKICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3F2/c1-2(3)4/h2H,1H2/q-1.
What are the key properties of 1,1-difluoroethane?
1,1-difluoroethane has a molecular weight of 65.04 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoroethane is sourced from PubChem (CID 102066194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).