2,6-dimethyl-4-methyliodanuidylphenol

C9H12IO- — CID 146709623

IUPAC2,6-dimethyl-4-methyliodanuidylphenol
SMILESC[I-]c1cc(C)c(O)c(C)c1
InChIInChI=1S/C9H12IO/c1-6-4-8(10-3)5-7(2)9(6)11/h4-5,11H,1-3H3/q-1
InChIKeyILTOYKSWJOQLCS-UHFFFAOYSA-N
MW263.10 g/mol
LogP-1.10
Rot. Bonds1

About 2,6-dimethyl-4-methyliodanuidylphenol

2,6-dimethyl-4-methyliodanuidylphenol (PubChem CID 146709623) has the molecular formula C9H12IO- and a molecular weight of 263.10 g/mol. Its IUPAC name is 2,6-dimethyl-4-methyliodanuidylphenol.

Molecular Properties

Compound Name2,6-dimethyl-4-methyliodanuidylphenol
PubChem CID146709623
Molecular FormulaC9H12IO-
Molecular Weight263.10 g/mol
Exact Mass262.99
IUPAC Name2,6-dimethyl-4-methyliodanuidylphenol
SMILESC[I-]c1cc(C)c(O)c(C)c1
InChIInChI=1S/C9H12IO/c1-6-4-8(10-3)5-7(2)9(6)11/h4-5,11H,1-3H3/q-1
InChIKeyILTOYKSWJOQLCS-UHFFFAOYSA-N
XLogP-1.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.10
LogP ≤ 5-1.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[(4-hydroxy-3,5-dimethylphenyl)diselanyl]-2,6-dimethylphenol
CID 59843656
4-[(4-hydroxy-3,5-dimethylphenyl)disulfanyl]-2,6-dimethylphenol
CID 23361225
4-[2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]-2,6-dimethylphenol
CID 54449458
4-(4-hydroxy-3,5-dimethylphenyl)phosphanyl-2,6-dimethylphenol
CID 146303412
4-[(4-hydroxy-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylphenol
CID 10458540
4-(4-hydroxy-3,5-dimethylphenyl)tellanyl-2,6-dimethylphenol
CID 10044622
4-[2-(4-hydroxy-3,5-dimethylphenyl)hydrazinyl]-2,6-dimethylphenol
CID 151482165
5-(4-hydroxy-3,5-dimethylphenyl)-3-methylbenzene-1,2-diol
CID 130228173
2,6-dimethyl-4-(methyldiazenyl)phenol
CID 136994157
4-ethyl-2,6-dimethylphenol;methane
CID 159618487
4-(2-aminopropan-2-yl)-2,6-dimethylphenol
CID 23620728
2,3,4-trifluoro-6-methylphenol
CID 54304883

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-methyliodanuidylphenol?
The IUPAC name of 2,6-dimethyl-4-methyliodanuidylphenol (CID 146709623) is 2,6-dimethyl-4-methyliodanuidylphenol.
What is the SMILES notation for 2,6-dimethyl-4-methyliodanuidylphenol?
The canonical SMILES for 2,6-dimethyl-4-methyliodanuidylphenol is C[I-]c1cc(C)c(O)c(C)c1.
What is the InChIKey of 2,6-dimethyl-4-methyliodanuidylphenol?
The InChIKey is ILTOYKSWJOQLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12IO/c1-6-4-8(10-3)5-7(2)9(6)11/h4-5,11H,1-3H3/q-1.
What are the key properties of 2,6-dimethyl-4-methyliodanuidylphenol?
2,6-dimethyl-4-methyliodanuidylphenol has a molecular weight of 263.10 g/mol, XLogP of -1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-methyliodanuidylphenol is sourced from PubChem (CID 146709623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).