ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene

C6H4F8 — CID 88622012

IUPACethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene
SMILESC=C.FC(F)=C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C4F8.C2H4/c5-2(6)1(3(7,8)9)4(10,11)12;1-2/h;1-2H2
InChIKeyMRCAALCZHGMPHP-UHFFFAOYSA-N
MW228.08 g/mol
LogP4.06
Rot. Bonds

About ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene

ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene (PubChem CID 88622012) has the molecular formula C6H4F8 and a molecular weight of 228.08 g/mol. Its IUPAC name is ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene.

Molecular Properties

Compound Nameethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene
PubChem CID88622012
Molecular FormulaC6H4F8
Molecular Weight228.08 g/mol
Exact Mass228.02
IUPAC Nameethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene
SMILESC=C.FC(F)=C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C4F8.C2H4/c5-2(6)1(3(7,8)9)4(10,11)12;1-2/h;1-2H2
InChIKeyMRCAALCZHGMPHP-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.08
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-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

Frequently Asked Questions

What is the IUPAC name of ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene?
The IUPAC name of ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene (CID 88622012) is ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene.
What is the SMILES notation for ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene?
The canonical SMILES for ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene is C=C.FC(F)=C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene?
The InChIKey is MRCAALCZHGMPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4F8.C2H4/c5-2(6)1(3(7,8)9)4(10,11)12;1-2/h;1-2H2.
What are the key properties of ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene?
ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene has a molecular weight of 228.08 g/mol, XLogP of 4.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene is sourced from PubChem (CID 88622012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).