1,1,2,3-tetrafluorobuta-1,3-diene

C4H2F4 — CID 23236060

IUPAC1,1,2,3-tetrafluorobuta-1,3-diene
SMILESC=C(F)C(F)=C(F)F
InChIInChI=1S/C4H2F4/c1-2(5)3(6)4(7)8/h1H2
InChIKeyNJVUNVISYDSXKR-UHFFFAOYSA-N
MW126.05 g/mol
LogP2.55
Rot. Bonds1

About 1,1,2,3-tetrafluorobuta-1,3-diene

1,1,2,3-tetrafluorobuta-1,3-diene (PubChem CID 23236060) has the molecular formula C4H2F4 and a molecular weight of 126.05 g/mol. Its IUPAC name is 1,1,2,3-tetrafluorobuta-1,3-diene.

Molecular Properties

Compound Name1,1,2,3-tetrafluorobuta-1,3-diene
PubChem CID23236060
Molecular FormulaC4H2F4
Molecular Weight126.05 g/mol
Exact Mass126.01
IUPAC Name1,1,2,3-tetrafluorobuta-1,3-diene
SMILESC=C(F)C(F)=C(F)F
InChIInChI=1S/C4H2F4/c1-2(5)3(6)4(7)8/h1H2
InChIKeyNJVUNVISYDSXKR-UHFFFAOYSA-N
XLogP2.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.05
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,3,3-Tetrafluoropropene
CID 2776731
1,2,3,3,3-Pentafluoropropene
CID 111077
1,1-Difluoroethene with 1,1,2,3,3,3-hexafluoro-1-propene (1:1)
CID 16212781
(E)-1,2,3,3,3-Pentafluoroprop-1-ene
CID 6329539
1,1-Difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;1,1,2,2-tetrafluoroethene
CID 168318
1,1,4,4-Tetrafluoro-1,3-butadiene
CID 136257
(1Z)-1,2,3,3,3-Pentafluoro-1-propene
CID 5708673
1,1,2,4,4-Pentafluoro-1,3-butadiene
CID 19748036
Fluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene
CID 87087075
1,1-Difluoroethene;1,1,2,3,3-pentafluoroprop-1-ene
CID 87126106
1,1-Difluoroethene;2,3,3,3-tetrafluoroprop-1-ene
CID 87251855
1,1,4,4,4-Pentafluorobuta-1,2-diene
CID 87447839

Frequently Asked Questions

What is the IUPAC name of 1,1,2,3-tetrafluorobuta-1,3-diene?
The IUPAC name of 1,1,2,3-tetrafluorobuta-1,3-diene (CID 23236060) is 1,1,2,3-tetrafluorobuta-1,3-diene.
What is the SMILES notation for 1,1,2,3-tetrafluorobuta-1,3-diene?
The canonical SMILES for 1,1,2,3-tetrafluorobuta-1,3-diene is C=C(F)C(F)=C(F)F.
What is the InChIKey of 1,1,2,3-tetrafluorobuta-1,3-diene?
The InChIKey is NJVUNVISYDSXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F4/c1-2(5)3(6)4(7)8/h1H2.
What are the key properties of 1,1,2,3-tetrafluorobuta-1,3-diene?
1,1,2,3-tetrafluorobuta-1,3-diene has a molecular weight of 126.05 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3-tetrafluorobuta-1,3-diene is sourced from PubChem (CID 23236060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).