1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane

C8H8F5I — CID 10853536

IUPAC1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane
SMILESFC(F)=C(F)C(F)(F)C1CCCC1I
InChIInChI=1S/C8H8F5I/c9-6(7(10)11)8(12,13)4-2-1-3-5(4)14/h4-5H,1-3H2
InChIKeyIJOBHEDEZOOIQR-UHFFFAOYSA-N
MW326.05 g/mol
LogP4.30
Rot. Bonds2

About 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane

1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane (PubChem CID 10853536) has the molecular formula C8H8F5I and a molecular weight of 326.05 g/mol. Its IUPAC name is 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane.

Molecular Properties

Compound Name1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane
PubChem CID10853536
Molecular FormulaC8H8F5I
Molecular Weight326.05 g/mol
Exact Mass325.96
IUPAC Name1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane
SMILESFC(F)=C(F)C(F)(F)C1CCCC1I
InChIInChI=1S/C8H8F5I/c9-6(7(10)11)8(12,13)4-2-1-3-5(4)14/h4-5H,1-3H2
InChIKeyIJOBHEDEZOOIQR-UHFFFAOYSA-N
XLogP4.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.05
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1,3,3,3-Pentafluoroprop-1-en-2-ylcyclopentane
CID 58999460
[3,3-Difluoro-2-(trifluoromethyl)prop-2-enyl]cyclopentane
CID 58999463
(1,1,2,3,3-Pentafluoro-allyl)cyclopentane
CID 10559935
1,1,2,3,3-Pentafluoro-5-iodo-4-propyloct-1-ene
CID 10642877
1-Iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclohexane
CID 15033845

Frequently Asked Questions

What is the IUPAC name of 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane?
The IUPAC name of 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane (CID 10853536) is 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane.
What is the SMILES notation for 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane?
The canonical SMILES for 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane is FC(F)=C(F)C(F)(F)C1CCCC1I.
What is the InChIKey of 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane?
The InChIKey is IJOBHEDEZOOIQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F5I/c9-6(7(10)11)8(12,13)4-2-1-3-5(4)14/h4-5H,1-3H2.
What are the key properties of 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane?
1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane has a molecular weight of 326.05 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-2-(1,1,2,3,3-pentafluoroprop-2-enyl)cyclopentane is sourced from PubChem (CID 10853536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).