lithium 1,1-difluoroprop-1-ene

C3H3F2Li — CID 12520956

IUPAClithium 1,1-difluoroprop-1-ene
SMILES[CH2-]C=C(F)F.[Li+]
InChIInChI=1S/C3H3F2.Li/c1-2-3(4)5;/h2H,1H2;/q-1;+1
InChIKeyJQDRITWEZBCYDH-UHFFFAOYSA-N
MW83.99 g/mol
LogP-1.40
Rot. Bonds

About lithium 1,1-difluoroprop-1-ene

lithium 1,1-difluoroprop-1-ene (PubChem CID 12520956) has the molecular formula C3H3F2Li and a molecular weight of 83.99 g/mol. Its IUPAC name is lithium 1,1-difluoroprop-1-ene.

Molecular Properties

Compound Namelithium 1,1-difluoroprop-1-ene
PubChem CID12520956
Molecular FormulaC3H3F2Li
Molecular Weight83.99 g/mol
Exact Mass84.04
IUPAC Namelithium 1,1-difluoroprop-1-ene
SMILES[CH2-]C=C(F)F.[Li+]
InChIInChI=1S/C3H3F2.Li/c1-2-3(4)5;/h2H,1H2;/q-1;+1
InChIKeyJQDRITWEZBCYDH-UHFFFAOYSA-N
XLogP-1.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.99
LogP ≤ 5-1.40
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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Related Compounds

3,3,3-Trifluoropropene
CID 12672
1,1,3,3,3-Pentafluoropropene
CID 69647
1,1-Difluoro-1,2-propadiene
CID 136273
1,1,3-Trifluoropropadiene
CID 21718125
4,4,4-Trifluorobuta-1,2-diene
CID 22159641
Lithium 1,1-difluoroprop-2-en-1-ide
CID 12591131
1,1,3,3-Tetrafluoropropene
CID 21731865
1,1,3-Trifluoroprop-1-ene
CID 22956412
1,3,3-Trifluoro-1-cyclopropene
CID 67290589
alpha-(Trifluoromethyl)vinyllithium
CID 85690328
1-(Trifluoromethyl)vinyllithium
CID 101388256
5,5,5-Trifluoropenta-1,2,3-triene
CID 21645020

Frequently Asked Questions

What is the IUPAC name of lithium 1,1-difluoroprop-1-ene?
The IUPAC name of lithium 1,1-difluoroprop-1-ene (CID 12520956) is lithium 1,1-difluoroprop-1-ene.
What is the SMILES notation for lithium 1,1-difluoroprop-1-ene?
The canonical SMILES for lithium 1,1-difluoroprop-1-ene is [CH2-]C=C(F)F.[Li+].
What is the InChIKey of lithium 1,1-difluoroprop-1-ene?
The InChIKey is JQDRITWEZBCYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F2.Li/c1-2-3(4)5;/h2H,1H2;/q-1;+1.
What are the key properties of lithium 1,1-difluoroprop-1-ene?
lithium 1,1-difluoroprop-1-ene has a molecular weight of 83.99 g/mol, XLogP of -1.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 1,1-difluoroprop-1-ene is sourced from PubChem (CID 12520956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).