2-[(4-hydroxyphenyl)methyl]-6-methylphenol

C14H14O2 — CID 91146240

IUPAC2-[(4-hydroxyphenyl)methyl]-6-methylphenol
SMILESCc1cccc(Cc2ccc(O)cc2)c1O
InChIInChI=1S/C14H14O2/c1-10-3-2-4-12(14(10)16)9-11-5-7-13(15)8-6-11/h2-8,15-16H,9H2,1H3
InChIKeyDTKCKQZKZYBFMH-UHFFFAOYSA-N
MW214.26 g/mol
LogP3.00
Rot. Bonds2

About 2-[(4-hydroxyphenyl)methyl]-6-methylphenol

2-[(4-hydroxyphenyl)methyl]-6-methylphenol (PubChem CID 91146240) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-[(4-hydroxyphenyl)methyl]-6-methylphenol.

Molecular Properties

Compound Name2-[(4-hydroxyphenyl)methyl]-6-methylphenol
PubChem CID91146240
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name2-[(4-hydroxyphenyl)methyl]-6-methylphenol
SMILESCc1cccc(Cc2ccc(O)cc2)c1O
InChIInChI=1S/C14H14O2/c1-10-3-2-4-12(14(10)16)9-11-5-7-13(15)8-6-11/h2-8,15-16H,9H2,1H3
InChIKeyDTKCKQZKZYBFMH-UHFFFAOYSA-N
XLogP3.00
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-hydroxyphenyl)methyl]-6-methylphenol?
The IUPAC name of 2-[(4-hydroxyphenyl)methyl]-6-methylphenol (CID 91146240) is 2-[(4-hydroxyphenyl)methyl]-6-methylphenol.
What is the SMILES notation for 2-[(4-hydroxyphenyl)methyl]-6-methylphenol?
The canonical SMILES for 2-[(4-hydroxyphenyl)methyl]-6-methylphenol is Cc1cccc(Cc2ccc(O)cc2)c1O.
What is the InChIKey of 2-[(4-hydroxyphenyl)methyl]-6-methylphenol?
The InChIKey is DTKCKQZKZYBFMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c1-10-3-2-4-12(14(10)16)9-11-5-7-13(15)8-6-11/h2-8,15-16H,9H2,1H3.
What are the key properties of 2-[(4-hydroxyphenyl)methyl]-6-methylphenol?
2-[(4-hydroxyphenyl)methyl]-6-methylphenol has a molecular weight of 214.26 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-hydroxyphenyl)methyl]-6-methylphenol is sourced from PubChem (CID 91146240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).