(4-methoxyphenyl)-(2-phenylethenyl)iodanium

C15H14IO+ — CID 88650705

IUPAC(4-methoxyphenyl)-(2-phenylethenyl)iodanium
SMILESCOc1ccc([I+]C=Cc2ccccc2)cc1
InChIInChI=1S/C15H14IO/c1-17-15-9-7-14(8-10-15)16-12-11-13-5-3-2-4-6-13/h2-12H,1H3/q+1
InChIKeyLNRUVRRRRNCJMM-UHFFFAOYSA-N
MW337.18 g/mol
LogP0.62
Rot. Bonds4

About (4-methoxyphenyl)-(2-phenylethenyl)iodanium

(4-methoxyphenyl)-(2-phenylethenyl)iodanium (PubChem CID 88650705) has the molecular formula C15H14IO+ and a molecular weight of 337.18 g/mol. Its IUPAC name is (4-methoxyphenyl)-(2-phenylethenyl)iodanium.

Molecular Properties

Compound Name(4-methoxyphenyl)-(2-phenylethenyl)iodanium
PubChem CID88650705
Molecular FormulaC15H14IO+
Molecular Weight337.18 g/mol
Exact Mass337.01
IUPAC Name(4-methoxyphenyl)-(2-phenylethenyl)iodanium
SMILESCOc1ccc([I+]C=Cc2ccccc2)cc1
InChIInChI=1S/C15H14IO/c1-17-15-9-7-14(8-10-15)16-12-11-13-5-3-2-4-6-13/h2-12H,1H3/q+1
InChIKeyLNRUVRRRRNCJMM-UHFFFAOYSA-N
XLogP0.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.18
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156
(4-methoxyphenyl)-(4-phenyliodoniophenyl)iodanium
CID 10259813
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
(4-methoxyphenyl)-phenyliodanium bromide
CID 11058256
tris(4-methoxyphenoxy)-[(E)-2-phenylethenyl]silane
CID 102056330
1-methoxy-4-[5-phenyl-3-[(E)-2-phenylethenyl]cyclopent-2-en-1-yl]benzene
CID 135006642
1-[(Z)-2-bromoethenyl]-4-methoxybenzene
CID 6166616
CID 135078844
CID 135078844
1-methoxy-4-(3-phenylcyclobutyl)benzene
CID 125465439
4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,6-diphenylthiopyrylium
CID 136884128
(E)-3-(4-methoxyphenyl)prop-2-enoyl chloride;toluene
CID 118117364
1-methoxy-4-[(E)-2-phenylselanylethenyl]benzene
CID 6288583

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(2-phenylethenyl)iodanium?
The IUPAC name of (4-methoxyphenyl)-(2-phenylethenyl)iodanium (CID 88650705) is (4-methoxyphenyl)-(2-phenylethenyl)iodanium.
What is the SMILES notation for (4-methoxyphenyl)-(2-phenylethenyl)iodanium?
The canonical SMILES for (4-methoxyphenyl)-(2-phenylethenyl)iodanium is COc1ccc([I+]C=Cc2ccccc2)cc1.
What is the InChIKey of (4-methoxyphenyl)-(2-phenylethenyl)iodanium?
The InChIKey is LNRUVRRRRNCJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14IO/c1-17-15-9-7-14(8-10-15)16-12-11-13-5-3-2-4-6-13/h2-12H,1H3/q+1.
What are the key properties of (4-methoxyphenyl)-(2-phenylethenyl)iodanium?
(4-methoxyphenyl)-(2-phenylethenyl)iodanium has a molecular weight of 337.18 g/mol, XLogP of 0.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(2-phenylethenyl)iodanium is sourced from PubChem (CID 88650705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).