2-methoxy-4-prop-2-enylphenol;hydroiodide

C10H13IO2 — CID 172782314

IUPAC2-methoxy-4-prop-2-enylphenol;hydroiodide
SMILESC=CCc1ccc(O)c(OC)c1.I
InChIInChI=1S/C10H12O2.HI/c1-3-4-8-5-6-9(11)10(7-8)12-2;/h3,5-7,11H,1,4H2,2H3;1H
InChIKeyGMJBLYVKBRBGLI-UHFFFAOYSA-N
MW292.12 g/mol
LogP2.75
Rot. Bonds3

About 2-methoxy-4-prop-2-enylphenol;hydroiodide

2-methoxy-4-prop-2-enylphenol;hydroiodide (PubChem CID 172782314) has the molecular formula C10H13IO2 and a molecular weight of 292.12 g/mol. Its IUPAC name is 2-methoxy-4-prop-2-enylphenol;hydroiodide.

Molecular Properties

Compound Name2-methoxy-4-prop-2-enylphenol;hydroiodide
PubChem CID172782314
Molecular FormulaC10H13IO2
Molecular Weight292.12 g/mol
Exact Mass292.00
IUPAC Name2-methoxy-4-prop-2-enylphenol;hydroiodide
SMILESC=CCc1ccc(O)c(OC)c1.I
InChIInChI=1S/C10H12O2.HI/c1-3-4-8-5-6-9(11)10(7-8)12-2;/h3,5-7,11H,1,4H2,2H3;1H
InChIKeyGMJBLYVKBRBGLI-UHFFFAOYSA-N
XLogP2.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.12
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 69284850
CID 69284850
buta-1,3-diene;bis(2-methoxy-4-prop-2-enylphenol)
CID 175132786
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CID 158780722
1-deuteriooxy-2-methoxy-4-prop-2-enylbenzene
CID 123654669
2-methoxy-4-prop-2-enylphenol;propanimidamide
CID 174912037
ethoxybenzene;2-methoxy-4-prop-2-enylphenol
CID 69392132
2-methoxy-4-prop-2-enylphenol;prop-1-enylbenzene
CID 78421503
1,2-dimethoxy-4-prop-2-enylbenzene;ethane
CID 143927430
2-methoxy-4-prop-2-enylphenol;2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol
CID 67418648
1-bromo-2-methoxy-4-prop-2-enylbenzene
CID 70188146
ethane;2-methoxy-1-methyl-4-prop-2-enylbenzene
CID 142811862

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-prop-2-enylphenol;hydroiodide?
The IUPAC name of 2-methoxy-4-prop-2-enylphenol;hydroiodide (CID 172782314) is 2-methoxy-4-prop-2-enylphenol;hydroiodide.
What is the SMILES notation for 2-methoxy-4-prop-2-enylphenol;hydroiodide?
The canonical SMILES for 2-methoxy-4-prop-2-enylphenol;hydroiodide is C=CCc1ccc(O)c(OC)c1.I.
What is the InChIKey of 2-methoxy-4-prop-2-enylphenol;hydroiodide?
The InChIKey is GMJBLYVKBRBGLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2.HI/c1-3-4-8-5-6-9(11)10(7-8)12-2;/h3,5-7,11H,1,4H2,2H3;1H.
What are the key properties of 2-methoxy-4-prop-2-enylphenol;hydroiodide?
2-methoxy-4-prop-2-enylphenol;hydroiodide has a molecular weight of 292.12 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-prop-2-enylphenol;hydroiodide is sourced from PubChem (CID 172782314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).