(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene

C6H6F6 — CID 21062403

IUPAC(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene
SMILESC/C(=C(\C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H6F6/c1-3(5(7,8)9)4(2)6(10,11)12/h1-2H3/b4-3-
InChIKeyRBBPZXVKYCZIFA-ARJAWSKDSA-N
MW192.10 g/mol
LogP3.45
Rot. Bonds

About (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene

(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene (PubChem CID 21062403) has the molecular formula C6H6F6 and a molecular weight of 192.10 g/mol. Its IUPAC name is (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene.

Molecular Properties

Compound Name(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene
PubChem CID21062403
Molecular FormulaC6H6F6
Molecular Weight192.10 g/mol
Exact Mass192.04
IUPAC Name(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene
SMILESC/C(=C(\C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H6F6/c1-3(5(7,8)9)4(2)6(10,11)12/h1-2H3/b4-3-
InChIKeyRBBPZXVKYCZIFA-ARJAWSKDSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.10
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene?
The IUPAC name of (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene (CID 21062403) is (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene.
What is the SMILES notation for (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene?
The canonical SMILES for (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene is C/C(=C(\C)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene?
The InChIKey is RBBPZXVKYCZIFA-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H6F6/c1-3(5(7,8)9)4(2)6(10,11)12/h1-2H3/b4-3-.
What are the key properties of (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene?
(Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene has a molecular weight of 192.10 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1,4,4,4-hexafluoro-2,3-dimethylbut-2-ene is sourced from PubChem (CID 21062403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).