phenyl-[(E)-prop-1-enyl]iodanium

C9H10I+ — CID 11290489

IUPACphenyl-[(E)-prop-1-enyl]iodanium
SMILESC/C=C/[I+]c1ccccc1
InChIInChI=1S/C9H10I/c1-2-8-10-9-6-4-3-5-7-9/h2-8H,1H3/q+1/b8-2+
InChIKeyANMDGZHTTMOPRT-KRXBUXKQSA-N
MW245.08 g/mol
LogP-0.52
Rot. Bonds2

About phenyl-[(E)-prop-1-enyl]iodanium

phenyl-[(E)-prop-1-enyl]iodanium (PubChem CID 11290489) has the molecular formula C9H10I+ and a molecular weight of 245.08 g/mol. Its IUPAC name is phenyl-[(E)-prop-1-enyl]iodanium.

Molecular Properties

Compound Namephenyl-[(E)-prop-1-enyl]iodanium
PubChem CID11290489
Molecular FormulaC9H10I+
Molecular Weight245.08 g/mol
Exact Mass244.98
IUPAC Namephenyl-[(E)-prop-1-enyl]iodanium
SMILESC/C=C/[I+]c1ccccc1
InChIInChI=1S/C9H10I/c1-2-8-10-9-6-4-3-5-7-9/h2-8H,1H3/q+1/b8-2+
InChIKeyANMDGZHTTMOPRT-KRXBUXKQSA-N
XLogP-0.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.08
LogP ≤ 5-0.52
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

[(E)-3-methoxyprop-1-enyl]-phenyliodanium
CID 10689983
[(E)-2-methylsulfonyloxyethenyl]-phenyliodanium
CID 5325297
[(E)-dec-1-enyl]-phenyliodanium
CID 10906117
phenyl-[(E)-2-phenylprop-1-enyl]iodanium
CID 12014626
(4-methoxyphenyl)-(2-phenylethenyl)iodanium
CID 88650705
[(Z)-2-chloro-3,3-dimethylbut-1-enyl]-phenyliodanium
CID 10763951
benzene;1,1'-biphenyl;(E)-but-2-ene;ethane
CID 161147131
benzene;cyclopropylbenzene
CID 144638417
diphenyliodanium;ethane;methane
CID 159636739
1-[(E)-but-2-enyl]-4-phenylpiperidine
CID 22888236
ethane;(2S)-2-phenylaziridine
CID 145185749
(4R,5R)-2-[(E)-but-2-enyl]-4,5-diphenyl-1,3,2-dioxaborolane
CID 101351257

Frequently Asked Questions

What is the IUPAC name of phenyl-[(E)-prop-1-enyl]iodanium?
The IUPAC name of phenyl-[(E)-prop-1-enyl]iodanium (CID 11290489) is phenyl-[(E)-prop-1-enyl]iodanium.
What is the SMILES notation for phenyl-[(E)-prop-1-enyl]iodanium?
The canonical SMILES for phenyl-[(E)-prop-1-enyl]iodanium is C/C=C/[I+]c1ccccc1.
What is the InChIKey of phenyl-[(E)-prop-1-enyl]iodanium?
The InChIKey is ANMDGZHTTMOPRT-KRXBUXKQSA-N. The full InChI is InChI=1S/C9H10I/c1-2-8-10-9-6-4-3-5-7-9/h2-8H,1H3/q+1/b8-2+.
What are the key properties of phenyl-[(E)-prop-1-enyl]iodanium?
phenyl-[(E)-prop-1-enyl]iodanium has a molecular weight of 245.08 g/mol, XLogP of -0.52, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[(E)-prop-1-enyl]iodanium is sourced from PubChem (CID 11290489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).