2-tert-butyl-4-(4-methoxyphenyl)phenol

C17H20O2 — CID 135087141

IUPAC2-tert-butyl-4-(4-methoxyphenyl)phenol
SMILESCOc1ccc(-c2ccc(O)c(C(C)(C)C)c2)cc1
InChIInChI=1S/C17H20O2/c1-17(2,3)15-11-13(7-10-16(15)18)12-5-8-14(19-4)9-6-12/h5-11,18H,1-4H3
InChIKeyRVQFVPJINCDYOT-UHFFFAOYSA-N
MW256.34 g/mol
LogP4.37
Rot. Bonds2

About 2-tert-butyl-4-(4-methoxyphenyl)phenol

2-tert-butyl-4-(4-methoxyphenyl)phenol (PubChem CID 135087141) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 2-tert-butyl-4-(4-methoxyphenyl)phenol.

Molecular Properties

Compound Name2-tert-butyl-4-(4-methoxyphenyl)phenol
PubChem CID135087141
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name2-tert-butyl-4-(4-methoxyphenyl)phenol
SMILESCOc1ccc(-c2ccc(O)c(C(C)(C)C)c2)cc1
InChIInChI=1S/C17H20O2/c1-17(2,3)15-11-13(7-10-16(15)18)12-5-8-14(19-4)9-6-12/h5-11,18H,1-4H3
InChIKeyRVQFVPJINCDYOT-UHFFFAOYSA-N
XLogP4.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-tert-butyl-4-(4-methoxyphenyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-tert-butyl-4-methoxyphenol;ethane
CID 91123159
2-tert-butyl-4-(3-tert-butyl-4-hydroxyphenoxy)phenol
CID 18178010
2-bromo-4-(4-methoxyphenyl)phenol
CID 11492848
2-tert-butyl-4-[5-(3-tert-butyl-4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol
CID 154164064
2-tert-butyl-4-(2-hydroxyethoxy)phenol
CID 18353567
(3-tert-butyl-4-hydroxyphenyl) dihydrogen phosphite
CID 175040177
2-tert-butyl-4-[4-(3-hydroxyprop-1-ynyl)phenyl]phenol
CID 155684013
2-tert-butyl-4-(4-cyclohexylphenyl)phenol
CID 19694694
[4-(3,4-dihydroxyphenyl)phenyl] 4-methoxybenzoate
CID 122595867
4-(4-methoxyphenyl)-2-prop-2-enylphenol
CID 54757995
2-tert-butylbenzene-1,4-diol;2,5-ditert-butylbenzene-1,4-diol;2,6-ditert-butyl-4-methylphenol;4-methoxyphenol;2-methylbenzene-1,4-diol
CID 158247324
4-methoxy-2-(2-methylbutan-2-yl)phenol
CID 11557455

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-(4-methoxyphenyl)phenol?
The IUPAC name of 2-tert-butyl-4-(4-methoxyphenyl)phenol (CID 135087141) is 2-tert-butyl-4-(4-methoxyphenyl)phenol.
What is the SMILES notation for 2-tert-butyl-4-(4-methoxyphenyl)phenol?
The canonical SMILES for 2-tert-butyl-4-(4-methoxyphenyl)phenol is COc1ccc(-c2ccc(O)c(C(C)(C)C)c2)cc1.
What is the InChIKey of 2-tert-butyl-4-(4-methoxyphenyl)phenol?
The InChIKey is RVQFVPJINCDYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-17(2,3)15-11-13(7-10-16(15)18)12-5-8-14(19-4)9-6-12/h5-11,18H,1-4H3.
What are the key properties of 2-tert-butyl-4-(4-methoxyphenyl)phenol?
2-tert-butyl-4-(4-methoxyphenyl)phenol has a molecular weight of 256.34 g/mol, XLogP of 4.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-(4-methoxyphenyl)phenol is sourced from PubChem (CID 135087141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).