3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene

C6H2F10 — CID 134361168

IUPAC3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene
SMILESC=C(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F10/c1-2(4(8,9)10)3(7,5(11,12)13)6(14,15)16/h1H2
InChIKeyXUKAUUMBNPOPKG-UHFFFAOYSA-N
MW264.06 g/mol
LogP3.94
Rot. Bonds1

About 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene

3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene (PubChem CID 134361168) has the molecular formula C6H2F10 and a molecular weight of 264.06 g/mol. Its IUPAC name is 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene.

Molecular Properties

Compound Name3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene
PubChem CID134361168
Molecular FormulaC6H2F10
Molecular Weight264.06 g/mol
Exact Mass264.00
IUPAC Name3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene
SMILESC=C(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F10/c1-2(4(8,9)10)3(7,5(11,12)13)6(14,15)16/h1H2
InChIKeyXUKAUUMBNPOPKG-UHFFFAOYSA-N
XLogP3.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.06
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,1-trifluoro-2-methyl-3-(trifluoromethyl)but-3-en-2-ol
CID 162534784
N,1,1-trifluoro-N-methyl-2-(trifluoromethyl)prop-2-en-1-amine
CID 146426215
astatane;2,3,3,3-tetrafluoroprop-1-ene
CID 174875947
1,1,1,2,2,3,3,4,4,6,6,7,7,8,8,9,9,9-octadecafluoro-5-methylidenenonane
CID 23437686
1,1,1,4,5,5,5-heptafluoro-4-(trifluoromethyl)pentane-2,3-dione
CID 12567521
3,3,4,4,4-pentafluoro-2-(3,3,4,4,4-pentafluorobut-1-en-2-yloxy)but-1-ene
CID 56625874
ethane;3,3,3-trifluoroprop-1-en-2-ol
CID 142267098
3-fluoro-3-methyl-4-(trifluoromethyl)pent-4-en-2-amine
CID 130574590
2-chloro-3,3,4,4,5,5,5-heptafluoropent-1-ene
CID 2773786
[1,1-difluoro-2-(trifluoromethyl)prop-2-enyl] trifluoromethanesulfonate
CID 10685163
N-(3,3,3-trifluoroprop-1-en-2-yl)methanimine
CID 162621100
tritert-butyl(3,3,3-trifluoroprop-1-en-2-yl)stannane
CID 125130358

Frequently Asked Questions

What is the IUPAC name of 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene?
The IUPAC name of 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene (CID 134361168) is 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene.
What is the SMILES notation for 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene?
The canonical SMILES for 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene is C=C(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene?
The InChIKey is XUKAUUMBNPOPKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F10/c1-2(4(8,9)10)3(7,5(11,12)13)6(14,15)16/h1H2.
What are the key properties of 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene?
3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene has a molecular weight of 264.06 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4,4-tetrafluoro-2,3-bis(trifluoromethyl)but-1-ene is sourced from PubChem (CID 134361168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).