3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol

C15H16O3 — CID 117242770

IUPAC3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol
SMILESCc1ccc(OCC(O)c2cccc(O)c2)cc1
InChIInChI=1S/C15H16O3/c1-11-5-7-14(8-6-11)18-10-15(17)12-3-2-4-13(16)9-12/h2-9,15-17H,10H2,1H3
InChIKeyUHUDNOYLJFGFIP-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.81
Rot. Bonds4

About 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol

3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol (PubChem CID 117242770) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol.

Molecular Properties

Compound Name3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol
PubChem CID117242770
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol
SMILESCc1ccc(OCC(O)c2cccc(O)c2)cc1
InChIInChI=1S/C15H16O3/c1-11-5-7-14(8-6-11)18-10-15(17)12-3-2-4-13(16)9-12/h2-9,15-17H,10H2,1H3
InChIKeyUHUDNOYLJFGFIP-UHFFFAOYSA-N
XLogP2.81
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-hydroxy-2-(2-methylphenoxy)ethyl]phenol
CID 117242661
4-[2-(3-bromophenyl)-2-hydroxyethoxy]phenol
CID 117242764
3-[2-amino-2-(4-methylphenyl)ethoxy]phenol
CID 117244597
1-(3-aminophenyl)-2-(4-chloro-3,5-dimethylphenoxy)ethanol
CID 62267931
1-(4-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]ethanol
CID 117244595
1-(3-methylphenyl)-2-quinolin-7-yloxyethanol
CID 107314538
4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
CID 117244685
1-[4-[2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]ethanone
CID 81133388
2-phenoxy-1-(3-propylphenyl)ethanol
CID 116543555
2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol
CID 115766354
4-[1-amino-2-(4-methylphenoxy)ethyl]phenol
CID 117244673
3-[(1R)-1-hydroxy-2-(trideuterio(113C)methylamino)ethyl]phenol
CID 76973806

Frequently Asked Questions

What is the IUPAC name of 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol?
The IUPAC name of 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol (CID 117242770) is 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol.
What is the SMILES notation for 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol?
The canonical SMILES for 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol is Cc1ccc(OCC(O)c2cccc(O)c2)cc1.
What is the InChIKey of 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol?
The InChIKey is UHUDNOYLJFGFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-11-5-7-14(8-6-11)18-10-15(17)12-3-2-4-13(16)9-12/h2-9,15-17H,10H2,1H3.
What are the key properties of 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol?
3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol has a molecular weight of 244.29 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol is sourced from PubChem (CID 117242770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).