1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene

C8F14 — CID 154989601

IUPAC1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene
SMILESFC1=C(C(F)(F)F)C(F)(C(F)(F)F)C1(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8F14/c9-2-1(5(11,12)13)4(10,8(20,21)22)3(2,6(14,15)16)7(17,18)19
InChIKeyUBAKLTFGVDWBMI-UHFFFAOYSA-N
MW362.06 g/mol
LogP5.17
Rot. Bonds

About 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene

1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene (PubChem CID 154989601) has the molecular formula C8F14 and a molecular weight of 362.06 g/mol. Its IUPAC name is 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene.

Molecular Properties

Compound Name1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene
PubChem CID154989601
Molecular FormulaC8F14
Molecular Weight362.06 g/mol
Exact Mass361.98
IUPAC Name1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene
SMILESFC1=C(C(F)(F)F)C(F)(C(F)(F)F)C1(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8F14/c9-2-1(5(11,12)13)4(10,8(20,21)22)3(2,6(14,15)16)7(17,18)19
InChIKeyUBAKLTFGVDWBMI-UHFFFAOYSA-N
XLogP5.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.06
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene?
The IUPAC name of 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene (CID 154989601) is 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene.
What is the SMILES notation for 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene?
The canonical SMILES for 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene is FC1=C(C(F)(F)F)C(F)(C(F)(F)F)C1(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene?
The InChIKey is UBAKLTFGVDWBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F14/c9-2-1(5(11,12)13)4(10,8(20,21)22)3(2,6(14,15)16)7(17,18)19.
What are the key properties of 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene?
1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene has a molecular weight of 362.06 g/mol, XLogP of 5.17, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-difluoro-2,3,4,4-tetrakis(trifluoromethyl)cyclobutene is sourced from PubChem (CID 154989601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).