3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol

C19H24O2 — CID 123417920

IUPAC3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol
SMILESCCC(C)(C)c1ccc(COc2cc(C)cc(O)c2)cc1
InChIInChI=1S/C19H24O2/c1-5-19(3,4)16-8-6-15(7-9-16)13-21-18-11-14(2)10-17(20)12-18/h6-12,20H,5,13H2,1-4H3
InChIKeyKUWSQWBRBKRVFT-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.97
Rot. Bonds5

About 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol

3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol (PubChem CID 123417920) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol.

Molecular Properties

Compound Name3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol
PubChem CID123417920
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol
SMILESCCC(C)(C)c1ccc(COc2cc(C)cc(O)c2)cc1
InChIInChI=1S/C19H24O2/c1-5-19(3,4)16-8-6-15(7-9-16)13-21-18-11-14(2)10-17(20)12-18/h6-12,20H,5,13H2,1-4H3
InChIKeyKUWSQWBRBKRVFT-UHFFFAOYSA-N
XLogP4.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-tert-butylphenyl)methoxy]-5-methylphenol
CID 107679876
3-[[4-(2-methylbutan-2-yl)phenoxy]methyl]phenol
CID 70563194
3-[(4-tert-butylphenyl)methoxy]-5-(hydroxymethyl)phenol
CID 101207534
3-[(4-tert-butylphenyl)methoxy]-5-methylbenzaldehyde
CID 122476290
3-[(3,5-dimethylphenoxy)methyl]-5-methoxyphenol
CID 70951574
3-(3,3-dimethylbutoxy)-5-methylphenol
CID 107679623
1-fluoro-3-[(4-fluorophenyl)methoxy]-5-methylbenzene
CID 143178239
3-[(1-ethylpyrazol-4-yl)methoxy]-5-methylphenol
CID 107679822
3-[3-[(3-fluorophenyl)methoxy]-5-methylphenoxy]-5-methylphenol
CID 175589747
3-decoxy-5-methylphenol
CID 107679752
5-[[3-[(3,5-dihydroxyphenyl)methoxy]-5-[[3-[[3-[(3,5-dihydroxyphenyl)methoxy]-5-[(3-hydroxy-5-methylphenyl)methoxy]phenyl]methoxy]-5-[(4-methylphenoxy)methyl]phenoxy]methyl]phenoxy]methyl]benzene-1,3-diol
CID 58912218
4-methyl-2-[4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]phenyl]-1,3-thiazole-5-carboxylate
CID 7745336

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol?
The IUPAC name of 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol (CID 123417920) is 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol.
What is the SMILES notation for 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol?
The canonical SMILES for 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol is CCC(C)(C)c1ccc(COc2cc(C)cc(O)c2)cc1.
What is the InChIKey of 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol?
The InChIKey is KUWSQWBRBKRVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-5-19(3,4)16-8-6-15(7-9-16)13-21-18-11-14(2)10-17(20)12-18/h6-12,20H,5,13H2,1-4H3.
What are the key properties of 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol?
3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol has a molecular weight of 284.40 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[[4-(2-methylbutan-2-yl)phenyl]methoxy]phenol is sourced from PubChem (CID 123417920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).