bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide

C6H5IO — CID 175265565

IUPACbicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide
SMILESI.Oc1cc2ccc1-2
InChIInChI=1S/C6H4O.HI/c7-6-3-4-1-2-5(4)6;/h1-3,7H;1H
InChIKeySKVPIWCSSVABIN-UHFFFAOYSA-N
MW220.01 g/mol
LogP1.99
Rot. Bonds

About bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide

bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide (PubChem CID 175265565) has the molecular formula C6H5IO and a molecular weight of 220.01 g/mol. Its IUPAC name is bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide.

Molecular Properties

Compound Namebicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide
PubChem CID175265565
Molecular FormulaC6H5IO
Molecular Weight220.01 g/mol
Exact Mass219.94
IUPAC Namebicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide
SMILESI.Oc1cc2ccc1-2
InChIInChI=1S/C6H4O.HI/c7-6-3-4-1-2-5(4)6;/h1-3,7H;1H
InChIKeySKVPIWCSSVABIN-UHFFFAOYSA-N
XLogP1.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.01
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide?
The IUPAC name of bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide (CID 175265565) is bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide.
What is the SMILES notation for bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide?
The canonical SMILES for bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide is I.Oc1cc2ccc1-2.
What is the InChIKey of bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide?
The InChIKey is SKVPIWCSSVABIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4O.HI/c7-6-3-4-1-2-5(4)6;/h1-3,7H;1H.
What are the key properties of bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide?
bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide has a molecular weight of 220.01 g/mol, XLogP of 1.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[2.2.0]hexa-1,3,5-trien-2-ol;hydroiodide is sourced from PubChem (CID 175265565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).