1-iodo-4-[(E)-2-iodoethenyl]benzene

C8H6I2 — CID 89017176

IUPAC1-iodo-4-[(E)-2-iodoethenyl]benzene
SMILESI/C=C/c1ccc(I)cc1
InChIInChI=1S/C8H6I2/c9-6-5-7-1-3-8(10)4-2-7/h1-6H/b6-5+
InChIKeyOKGKQQIFECALCY-AATRIKPKSA-N
MW355.94 g/mol
LogP3.70
Rot. Bonds1

About 1-iodo-4-[(E)-2-iodoethenyl]benzene

1-iodo-4-[(E)-2-iodoethenyl]benzene (PubChem CID 89017176) has the molecular formula C8H6I2 and a molecular weight of 355.94 g/mol. Its IUPAC name is 1-iodo-4-[(E)-2-iodoethenyl]benzene.

Molecular Properties

Compound Name1-iodo-4-[(E)-2-iodoethenyl]benzene
PubChem CID89017176
Molecular FormulaC8H6I2
Molecular Weight355.94 g/mol
Exact Mass355.86
IUPAC Name1-iodo-4-[(E)-2-iodoethenyl]benzene
SMILESI/C=C/c1ccc(I)cc1
InChIInChI=1S/C8H6I2/c9-6-5-7-1-3-8(10)4-2-7/h1-6H/b6-5+
InChIKeyOKGKQQIFECALCY-AATRIKPKSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.94
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-[(E)-2-bromoethenyl]-4-iodobenzene
CID 45358242
1-ethenyl-4-[(E)-2-iodoethenyl]benzene
CID 24873640
3-(4-iodophenyl)prop-2-enenitrile
CID 67242782
1-iodo-4-[2-[2-(4-iodophenyl)ethenylsulfonyl]ethenyl]benzene
CID 139796527
[4-(2-iodoethenyl)phenyl]methanamine
CID 174758565
1-iodo-4-[(E)-2-methoxyethenyl]benzene
CID 122627651
4-[(E)-2-(4-iodophenyl)ethenyl]-N,N-dimethylaniline
CID 10936986
(E)-3-(4-iodophenyl)-N-methylprop-2-enamide
CID 147337787
1-iodo-4-[(E)-2-[[(E)-2-(4-iodophenyl)ethenyl]sulfonylmethylsulfonyl]ethenyl]benzene
CID 86619224
(E)-2-(4-iodophenyl)-N-[(E)-2-(4-iodophenyl)ethenyl]sulfinylethenesulfinamide
CID 11635505
(E)-3-[4-(4-iodophenoxy)phenyl]prop-2-enoic acid
CID 43327337
4-[4-(4-iodophenyl)phenyl]benzaldehyde
CID 58568967

Frequently Asked Questions

What is the IUPAC name of 1-iodo-4-[(E)-2-iodoethenyl]benzene?
The IUPAC name of 1-iodo-4-[(E)-2-iodoethenyl]benzene (CID 89017176) is 1-iodo-4-[(E)-2-iodoethenyl]benzene.
What is the SMILES notation for 1-iodo-4-[(E)-2-iodoethenyl]benzene?
The canonical SMILES for 1-iodo-4-[(E)-2-iodoethenyl]benzene is I/C=C/c1ccc(I)cc1.
What is the InChIKey of 1-iodo-4-[(E)-2-iodoethenyl]benzene?
The InChIKey is OKGKQQIFECALCY-AATRIKPKSA-N. The full InChI is InChI=1S/C8H6I2/c9-6-5-7-1-3-8(10)4-2-7/h1-6H/b6-5+.
What are the key properties of 1-iodo-4-[(E)-2-iodoethenyl]benzene?
1-iodo-4-[(E)-2-iodoethenyl]benzene has a molecular weight of 355.94 g/mol, XLogP of 3.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-4-[(E)-2-iodoethenyl]benzene is sourced from PubChem (CID 89017176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).