2-(4-hydroxy-3-methylphenoxy)-6-methylphenol

C14H14O3 — CID 66844209

IUPAC2-(4-hydroxy-3-methylphenoxy)-6-methylphenol
SMILESCc1cc(Oc2cccc(C)c2O)ccc1O
InChIInChI=1S/C14H14O3/c1-9-4-3-5-13(14(9)16)17-11-6-7-12(15)10(2)8-11/h3-8,15-16H,1-2H3
InChIKeyBEZFWJUZZJUBQI-UHFFFAOYSA-N
MW230.26 g/mol
LogP3.51
Rot. Bonds2

About 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol

2-(4-hydroxy-3-methylphenoxy)-6-methylphenol (PubChem CID 66844209) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol.

Molecular Properties

Compound Name2-(4-hydroxy-3-methylphenoxy)-6-methylphenol
PubChem CID66844209
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name2-(4-hydroxy-3-methylphenoxy)-6-methylphenol
SMILESCc1cc(Oc2cccc(C)c2O)ccc1O
InChIInChI=1S/C14H14O3/c1-9-4-3-5-13(14(9)16)17-11-6-7-12(15)10(2)8-11/h3-8,15-16H,1-2H3
InChIKeyBEZFWJUZZJUBQI-UHFFFAOYSA-N
XLogP3.51
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4-phenoxyphenol
CID 23089676
[2-(4-hydroxy-3-methylphenoxy)phenyl]-phenylmethanone
CID 67943677
2,4-dimethylphenol;2,6-dimethylphenol;methane
CID 162172477
2-[4-(3-hydroxy-N-(3-hydroxy-2-methylphenyl)-2-methylanilino)phenoxy]-6-methylphenol
CID 101332153
2-(2-fluorophenoxy)-6-methylphenol
CID 20513456
5-(2,3-dihydroxyphenoxy)benzene-1,2,3-triol
CID 19426542
2,4-bis(3-methylphenoxy)phenol
CID 139941781
2-[2-(2-hydroxy-3-methylphenoxy)ethoxy]-6-methylphenol
CID 174709972
2-(3-methylphenoxy)phenol
CID 22051950
2,6-dimethylphenol;4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]-2-methylphenol
CID 141474948
3-methylbenzene-1,2-diol
CID 135381405
2-hydroxy-4-(2-methylphenoxy)benzoic acid
CID 164975487

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol?
The IUPAC name of 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol (CID 66844209) is 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol.
What is the SMILES notation for 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol?
The canonical SMILES for 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol is Cc1cc(Oc2cccc(C)c2O)ccc1O.
What is the InChIKey of 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol?
The InChIKey is BEZFWJUZZJUBQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c1-9-4-3-5-13(14(9)16)17-11-6-7-12(15)10(2)8-11/h3-8,15-16H,1-2H3.
What are the key properties of 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol?
2-(4-hydroxy-3-methylphenoxy)-6-methylphenol has a molecular weight of 230.26 g/mol, XLogP of 3.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-3-methylphenoxy)-6-methylphenol is sourced from PubChem (CID 66844209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).