[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane

C10H14F3I — CID 11301569

IUPAC[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane
SMILESFC(F)(F)C/C(I)=C/C1CCCCC1
InChIInChI=1S/C10H14F3I/c11-10(12,13)7-9(14)6-8-4-2-1-3-5-8/h6,8H,1-5,7H2/b9-6-
InChIKeyGTAIYYJNVNFGTJ-TWGQIWQCSA-N
MW318.12 g/mol
LogP4.84
Rot. Bonds2

About [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane

[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane (PubChem CID 11301569) has the molecular formula C10H14F3I and a molecular weight of 318.12 g/mol. Its IUPAC name is [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane.

Molecular Properties

Compound Name[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane
PubChem CID11301569
Molecular FormulaC10H14F3I
Molecular Weight318.12 g/mol
Exact Mass318.01
IUPAC Name[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane
SMILESFC(F)(F)C/C(I)=C/C1CCCCC1
InChIInChI=1S/C10H14F3I/c11-10(12,13)7-9(14)6-8-4-2-1-3-5-8/h6,8H,1-5,7H2/b9-6-
InChIKeyGTAIYYJNVNFGTJ-TWGQIWQCSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.12
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(E)-2-iodobut-1-enyl]cyclohexane
CID 11219259
[(Z)-2-bromo-2-iodoethenyl]cyclohexane
CID 134933225
2,2-difluoroethenylcyclohexane
CID 22182864
[(E)-2,3,3,3-tetrafluoroprop-1-enyl]cyclopentane
CID 11480825
[(E)-3-iodo-2-methylprop-1-enyl]cyclohexane
CID 91620287
1-cycloheptyl-3,3,3-trifluoropropan-1-one
CID 82932563
(Z)-3-cyclopentyl-2-iodoprop-2-enoic acid
CID 87262408
[(E)-3-bromo-2-methylprop-1-enyl]cyclohexane
CID 131275429
2-(cycloheptylmethylidene)butan-1-ol
CID 79335200
N-tert-butyl-3-cyclooctyl-2-methylprop-2-en-1-amine
CID 114207977
cyclohexanamine;2,2,2-trifluoroethanol
CID 173402481
3-cyclopentyl-2-methylprop-2-en-1-ol
CID 79334568

Frequently Asked Questions

What is the IUPAC name of [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane?
The IUPAC name of [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane (CID 11301569) is [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane.
What is the SMILES notation for [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane?
The canonical SMILES for [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane is FC(F)(F)C/C(I)=C/C1CCCCC1.
What is the InChIKey of [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane?
The InChIKey is GTAIYYJNVNFGTJ-TWGQIWQCSA-N. The full InChI is InChI=1S/C10H14F3I/c11-10(12,13)7-9(14)6-8-4-2-1-3-5-8/h6,8H,1-5,7H2/b9-6-.
What are the key properties of [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane?
[(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane has a molecular weight of 318.12 g/mol, XLogP of 4.84, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-4,4,4-trifluoro-2-iodobut-1-enyl]cyclohexane is sourced from PubChem (CID 11301569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).