benzene;hydroiodide

C6H7I — CID 69009885

IUPACbenzene;hydroiodide
SMILESI.c1ccccc1
InChIInChI=1S/C6H6.HI/c1-2-4-6-5-3-1;/h1-6H;1H
InChIKeyPYFCLQYKRRBQFK-UHFFFAOYSA-N
MW206.03 g/mol
LogP2.30
Rot. Bonds

About benzene;hydroiodide

benzene;hydroiodide (PubChem CID 69009885) has the molecular formula C6H7I and a molecular weight of 206.03 g/mol. Its IUPAC name is benzene;hydroiodide.

Molecular Properties

Compound Namebenzene;hydroiodide
PubChem CID69009885
Molecular FormulaC6H7I
Molecular Weight206.03 g/mol
Exact Mass205.96
IUPAC Namebenzene;hydroiodide
SMILESI.c1ccccc1
InChIInChI=1S/C6H6.HI/c1-2-4-6-5-3-1;/h1-6H;1H
InChIKeyPYFCLQYKRRBQFK-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.03
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzene;hydroiodide?
The IUPAC name of benzene;hydroiodide (CID 69009885) is benzene;hydroiodide.
What is the SMILES notation for benzene;hydroiodide?
The canonical SMILES for benzene;hydroiodide is I.c1ccccc1.
What is the InChIKey of benzene;hydroiodide?
The InChIKey is PYFCLQYKRRBQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.HI/c1-2-4-6-5-3-1;/h1-6H;1H.
What are the key properties of benzene;hydroiodide?
benzene;hydroiodide has a molecular weight of 206.03 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;hydroiodide is sourced from PubChem (CID 69009885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).