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

C15H15IO — CID 63017730

IUPAC1-(4-iodophenyl)-2-(4-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IO/c1-11-2-4-12(5-3-11)10-15(17)13-6-8-14(16)9-7-13/h2-9,15,17H,10H2,1H3
InChIKeyAPICPGLYDJVRTM-UHFFFAOYSA-N
MW338.19 g/mol
LogP3.88
Rot. Bonds3

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

1-(4-iodophenyl)-2-(4-methylphenyl)ethanol (PubChem CID 63017730) has the molecular formula C15H15IO and a molecular weight of 338.19 g/mol. Its IUPAC name is 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(4-iodophenyl)-2-(4-methylphenyl)ethanol
PubChem CID63017730
Molecular FormulaC15H15IO
Molecular Weight338.19 g/mol
Exact Mass338.02
IUPAC Name1-(4-iodophenyl)-2-(4-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IO/c1-11-2-4-12(5-3-11)10-15(17)13-6-8-14(16)9-7-13/h2-9,15,17H,10H2,1H3
InChIKeyAPICPGLYDJVRTM-UHFFFAOYSA-N
XLogP3.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.19
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethylphenyl)-1-(4-iodophenyl)ethanol
CID 63519463
2-(4-chlorophenyl)-1-(4-methylphenyl)ethanol
CID 60798981
1-(4-iodophenyl)-2-(4-methoxyphenyl)ethanol
CID 55149346
2-(4-iodophenyl)-1-(4-methylphenyl)ethanamine
CID 65477285
1-(3-iodophenyl)-2-(4-methylphenyl)ethanol
CID 63017729
2-(4-iodophenyl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 65479087
1-(4-iodophenyl)-2-(5-methyl-2-pyridinyl)ethanol
CID 66460323
1-(4-cyclopropylphenyl)-2-(4-iodophenyl)ethanol
CID 79981039
1-[4-(difluoromethoxy)phenyl]-2-(4-methylphenyl)ethanol
CID 63017905
1-iodo-4-[2-(4-methylphenyl)ethyl]benzene
CID 118487182
N-[1-(4-iodophenyl)-2-(4-methylphenyl)ethyl]propan-1-amine
CID 63527594
2-(furan-3-yl)-1-(4-methylphenyl)ethanol
CID 11206462

Frequently Asked Questions

What is the IUPAC name of 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol?
The IUPAC name of 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol (CID 63017730) is 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol.
What is the SMILES notation for 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol?
The canonical SMILES for 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol is Cc1ccc(CC(O)c2ccc(I)cc2)cc1.
What is the InChIKey of 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol?
The InChIKey is APICPGLYDJVRTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IO/c1-11-2-4-12(5-3-11)10-15(17)13-6-8-14(16)9-7-13/h2-9,15,17H,10H2,1H3.
What are the key properties of 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol?
1-(4-iodophenyl)-2-(4-methylphenyl)ethanol has a molecular weight of 338.19 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-iodophenyl)-2-(4-methylphenyl)ethanol is sourced from PubChem (CID 63017730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).