1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane

C6H5F5 — CID 12062190

IUPAC1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane
SMILESC/C=C/C1(F)C(F)(F)C1(F)F
InChIInChI=1S/C6H5F5/c1-2-3-4(7)5(8,9)6(4,10)11/h2-3H,1H3/b3-2+
InChIKeyUZDGAVIENXMVMD-NSCUHMNNSA-N
MW172.10 g/mol
LogP2.56
Rot. Bonds1

About 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane

1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane (PubChem CID 12062190) has the molecular formula C6H5F5 and a molecular weight of 172.10 g/mol. Its IUPAC name is 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane.

Molecular Properties

Compound Name1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane
PubChem CID12062190
Molecular FormulaC6H5F5
Molecular Weight172.10 g/mol
Exact Mass172.03
IUPAC Name1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane
SMILESC/C=C/C1(F)C(F)(F)C1(F)F
InChIInChI=1S/C6H5F5/c1-2-3-4(7)5(8,9)6(4,10)11/h2-3H,1H3/b3-2+
InChIKeyUZDGAVIENXMVMD-NSCUHMNNSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.10
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-Propenylperfluoropropane
CID 2774912
(2E)-4,4,5,5,6,6,6-Heptafluorohex-2-ene
CID 5708518
5,5,6,6,7,7,7-Heptafluorohept-3-ene
CID 138396277
4,5,5,6,6,6-Hexafluoro-4-(trifluoromethyl)hex-2-ene
CID 5372631
(E)-5,5,5-trifluoro-4,4-bis(trifluoromethyl)pent-2-ene
CID 23236402
1,1-Difluoro-2-(trans-1-propenyl)cyclopropane
CID 5463532
(E)-1,1,1,5,5,5-hexafluoro-4-methylpent-2-ene
CID 12578249
1,1-difluoro-2-[(Z)-prop-1-enyl]cyclopropane
CID 12757172
1,1-Difluoro-2-[(E)-ethylidene]cyclopropane
CID 91691214
1,1-Difluoro-2-prop-1-enylcyclopropane
CID 144894
CID 588119
CID 588119
4,5,5,5-Tetrafluoro-4-(trifluoromethyl)-2-pentene
CID 2776806

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane?
The IUPAC name of 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane (CID 12062190) is 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane.
What is the SMILES notation for 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane?
The canonical SMILES for 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane is C/C=C/C1(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane?
The InChIKey is UZDGAVIENXMVMD-NSCUHMNNSA-N. The full InChI is InChI=1S/C6H5F5/c1-2-3-4(7)5(8,9)6(4,10)11/h2-3H,1H3/b3-2+.
What are the key properties of 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane?
1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane has a molecular weight of 172.10 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3-pentafluoro-3-[(E)-prop-1-enyl]cyclopropane is sourced from PubChem (CID 12062190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).