3,5-bis[2-(4-methoxyphenyl)ethyl]phenol

C24H26O3 — CID 172870864

IUPAC3,5-bis[2-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(CCc2cc(O)cc(CCc3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C24H26O3/c1-26-23-11-7-18(8-12-23)3-5-20-15-21(17-22(25)16-20)6-4-19-9-13-24(27-2)14-10-19/h7-17,25H,3-6H2,1-2H3
InChIKeyPRGYNAZBHZUCOD-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.98
Rot. Bonds8

About 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol

3,5-bis[2-(4-methoxyphenyl)ethyl]phenol (PubChem CID 172870864) has the molecular formula C24H26O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol.

Molecular Properties

Compound Name3,5-bis[2-(4-methoxyphenyl)ethyl]phenol
PubChem CID172870864
Molecular FormulaC24H26O3
Molecular Weight362.47 g/mol
Exact Mass362.19
IUPAC Name3,5-bis[2-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(CCc2cc(O)cc(CCc3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C24H26O3/c1-26-23-11-7-18(8-12-23)3-5-20-15-21(17-22(25)16-20)6-4-19-9-13-24(27-2)14-10-19/h7-17,25H,3-6H2,1-2H3
InChIKeyPRGYNAZBHZUCOD-UHFFFAOYSA-N
XLogP4.98
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(4-methoxyphenyl)ethyl]phenol
CID 71375357
3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol
CID 143727870
1-methoxy-3-[2-(4-methoxyphenyl)ethyl]-5-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]benzene
CID 172871171
5-[2-(4-methoxyphenyl)ethyl]benzene-1,3-dicarboxylic acid
CID 174499523
[4-[2-(3,5-dihydroxyphenyl)ethyl]phenyl] 2-(6-methoxynaphthalen-2-yl)propanoate
CID 89034844
2-(hydroxymethyl)-4-[2-(4-methoxyphenyl)ethyl]phenol
CID 70230717
4-[2-(4-hydroxyphenyl)ethyl]-2-[2-methoxy-5-[2-(4-methoxyphenyl)ethyl]phenyl]phenol
CID 172870463
3,5-bis(2-naphthalen-2-ylethyl)phenol
CID 171715370
1,2,3-trimethoxy-5-[2-[3-[2-(4-methoxyphenyl)ethyl]phenyl]ethyl]benzene
CID 171715581
4-[2-[(4-methoxyphenyl)methoxy]ethyl]phenol
CID 22157586
[4-[2-(4-methoxyphenyl)ethyl]phenyl] acetate
CID 22081615
4-(2-aminoethyl)aniline;4-(2-aminoethyl)phenol;2-(4-methoxyphenyl)ethanamine
CID 70275717

Frequently Asked Questions

What is the IUPAC name of 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol?
The IUPAC name of 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol (CID 172870864) is 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol.
What is the SMILES notation for 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol?
The canonical SMILES for 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol is COc1ccc(CCc2cc(O)cc(CCc3ccc(OC)cc3)c2)cc1.
What is the InChIKey of 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol?
The InChIKey is PRGYNAZBHZUCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O3/c1-26-23-11-7-18(8-12-23)3-5-20-15-21(17-22(25)16-20)6-4-19-9-13-24(27-2)14-10-19/h7-17,25H,3-6H2,1-2H3.
What are the key properties of 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol?
3,5-bis[2-(4-methoxyphenyl)ethyl]phenol has a molecular weight of 362.47 g/mol, XLogP of 4.98, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis[2-(4-methoxyphenyl)ethyl]phenol is sourced from PubChem (CID 172870864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).