1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol

C15H15IO2 — CID 55149346

IUPAC1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IO2/c1-18-14-8-2-11(3-9-14)10-15(17)12-4-6-13(16)7-5-12/h2-9,15,17H,10H2,1H3
InChIKeyNWWNHRYBIDXQEE-UHFFFAOYSA-N
MW354.19 g/mol
LogP3.58
Rot. Bonds4

About 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol

1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol (PubChem CID 55149346) has the molecular formula C15H15IO2 and a molecular weight of 354.19 g/mol. Its IUPAC name is 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol
PubChem CID55149346
Molecular FormulaC15H15IO2
Molecular Weight354.19 g/mol
Exact Mass354.01
IUPAC Name1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IO2/c1-18-14-8-2-11(3-9-14)10-15(17)12-4-6-13(16)7-5-12/h2-9,15,17H,10H2,1H3
InChIKeyNWWNHRYBIDXQEE-UHFFFAOYSA-N
XLogP3.58
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.19
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-iodophenyl)-2-(4-methylphenyl)ethanol
CID 63017730
(4-iodophenyl)-(4-methoxyphenyl)methanol
CID 61098998
1-(4-iodophenyl)-4-(4-methoxyphenyl)butan-2-ol
CID 115802735
1-(4-cyclopropyloxyphenyl)-2-(4-methoxyphenyl)ethanol
CID 114519008
1-(3-bromo-4-methoxyphenyl)-2-(4-iodophenyl)ethanol
CID 65476638
2-(3,4-dimethylphenyl)-1-(4-iodophenyl)ethanol
CID 63519463
1-(4-methoxyphenyl)(213C)ethane-1,2-diol
CID 101170566
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)ethanol
CID 62622685
2-(4-iodophenyl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 65479087
1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanol
CID 60798818
1-[4-[(4-iodophenyl)methoxy]phenyl]propan-1-ol
CID 65476802
2-chloro-1-(4-methoxyphenyl)ethanol
CID 12862876

Frequently Asked Questions

What is the IUPAC name of 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol (CID 55149346) is 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol is COc1ccc(CC(O)c2ccc(I)cc2)cc1.
What is the InChIKey of 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol?
The InChIKey is NWWNHRYBIDXQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IO2/c1-18-14-8-2-11(3-9-14)10-15(17)12-4-6-13(16)7-5-12/h2-9,15,17H,10H2,1H3.
What are the key properties of 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol?
1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol has a molecular weight of 354.19 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 55149346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).