1-[4-(3-methoxyphenoxy)phenyl]ethanol

C15H16O3 — CID 43506404

IUPAC1-[4-(3-methoxyphenoxy)phenyl]ethanol
SMILESCOc1cccc(Oc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C15H16O3/c1-11(16)12-6-8-13(9-7-12)18-15-5-3-4-14(10-15)17-2/h3-11,16H,1-2H3
InChIKeyIYHBEEZVNQBAEQ-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.54
Rot. Bonds4

About 1-[4-(3-methoxyphenoxy)phenyl]ethanol

1-[4-(3-methoxyphenoxy)phenyl]ethanol (PubChem CID 43506404) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-[4-(3-methoxyphenoxy)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-(3-methoxyphenoxy)phenyl]ethanol
PubChem CID43506404
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name1-[4-(3-methoxyphenoxy)phenyl]ethanol
SMILESCOc1cccc(Oc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C15H16O3/c1-11(16)12-6-8-13(9-7-12)18-15-5-3-4-14(10-15)17-2/h3-11,16H,1-2H3
InChIKeyIYHBEEZVNQBAEQ-UHFFFAOYSA-N
XLogP3.54
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-methoxyphenoxy)phenyl]ethanol?
The IUPAC name of 1-[4-(3-methoxyphenoxy)phenyl]ethanol (CID 43506404) is 1-[4-(3-methoxyphenoxy)phenyl]ethanol.
What is the SMILES notation for 1-[4-(3-methoxyphenoxy)phenyl]ethanol?
The canonical SMILES for 1-[4-(3-methoxyphenoxy)phenyl]ethanol is COc1cccc(Oc2ccc(C(C)O)cc2)c1.
What is the InChIKey of 1-[4-(3-methoxyphenoxy)phenyl]ethanol?
The InChIKey is IYHBEEZVNQBAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-11(16)12-6-8-13(9-7-12)18-15-5-3-4-14(10-15)17-2/h3-11,16H,1-2H3.
What are the key properties of 1-[4-(3-methoxyphenoxy)phenyl]ethanol?
1-[4-(3-methoxyphenoxy)phenyl]ethanol has a molecular weight of 244.29 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-methoxyphenoxy)phenyl]ethanol is sourced from PubChem (CID 43506404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).