4-[2-(4-methoxyphenyl)butan-2-yl]phenol

C17H20O2 — CID 57308830

IUPAC4-[2-(4-methoxyphenyl)butan-2-yl]phenol
SMILESCCC(C)(c1ccc(O)cc1)c1ccc(OC)cc1
InChIInChI=1S/C17H20O2/c1-4-17(2,13-5-9-15(18)10-6-13)14-7-11-16(19-3)12-8-14/h5-12,18H,4H2,1-3H3
InChIKeyCHHJSNSWULNSCI-UHFFFAOYSA-N
MW256.34 g/mol
LogP4.12
Rot. Bonds4

About 4-[2-(4-methoxyphenyl)butan-2-yl]phenol

4-[2-(4-methoxyphenyl)butan-2-yl]phenol (PubChem CID 57308830) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 4-[2-(4-methoxyphenyl)butan-2-yl]phenol.

Molecular Properties

Compound Name4-[2-(4-methoxyphenyl)butan-2-yl]phenol
PubChem CID57308830
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name4-[2-(4-methoxyphenyl)butan-2-yl]phenol
SMILESCCC(C)(c1ccc(O)cc1)c1ccc(OC)cc1
InChIInChI=1S/C17H20O2/c1-4-17(2,13-5-9-15(18)10-6-13)14-7-11-16(19-3)12-8-14/h5-12,18H,4H2,1-3H3
InChIKeyCHHJSNSWULNSCI-UHFFFAOYSA-N
XLogP4.12
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)propyl]phenol
CID 22051947
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 19875161
ethane;4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 91273565
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol;tungsten
CID 158462536
2-(4-methoxyphenyl)butan-2-ol
CID 10307904
methane;4-methoxyphenol
CID 159494332
bis(4-methoxyphenol);zirconium(2+);dichloride
CID 172849740
4-[1-(4-hydroxyphenyl)-1-phenylpropyl]phenol;4-methoxy-N-(4-methoxyphenyl)aniline
CID 18698969
1-[(3E,5Z)-hepta-1,3,5-trien-4-yl]oxy-4-[2-(4-methoxyphenyl)butan-2-yl]benzene
CID 143671563
1-[2,4-bis(4-methoxyphenyl)-4-methylpentan-2-yl]-4-methoxybenzene
CID 633671
4-[2-[4-[[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]-dimethylsilyl]oxyphenyl]propan-2-yl]phenol
CID 140743150
2-tert-butyl-6-methoxynaphthalene;6-tert-butylnaphthalen-2-ol
CID 159191921

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methoxyphenyl)butan-2-yl]phenol?
The IUPAC name of 4-[2-(4-methoxyphenyl)butan-2-yl]phenol (CID 57308830) is 4-[2-(4-methoxyphenyl)butan-2-yl]phenol.
What is the SMILES notation for 4-[2-(4-methoxyphenyl)butan-2-yl]phenol?
The canonical SMILES for 4-[2-(4-methoxyphenyl)butan-2-yl]phenol is CCC(C)(c1ccc(O)cc1)c1ccc(OC)cc1.
What is the InChIKey of 4-[2-(4-methoxyphenyl)butan-2-yl]phenol?
The InChIKey is CHHJSNSWULNSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-4-17(2,13-5-9-15(18)10-6-13)14-7-11-16(19-3)12-8-14/h5-12,18H,4H2,1-3H3.
What are the key properties of 4-[2-(4-methoxyphenyl)butan-2-yl]phenol?
4-[2-(4-methoxyphenyl)butan-2-yl]phenol has a molecular weight of 256.34 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methoxyphenyl)butan-2-yl]phenol is sourced from PubChem (CID 57308830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).