5-methyl-2-phenoxyphenol

C13H12O2 — CID 5271322

IUPAC5-methyl-2-phenoxyphenol
SMILESCc1ccc(Oc2ccccc2)c(O)c1
InChIInChI=1S/C13H12O2/c1-10-7-8-13(12(14)9-10)15-11-5-3-2-4-6-11/h2-9,14H,1H3
InChIKeyHUPPMDCSGSHZHI-UHFFFAOYSA-N
MW200.24 g/mol
LogP3.49
Rot. Bonds2

About 5-methyl-2-phenoxyphenol

5-methyl-2-phenoxyphenol (PubChem CID 5271322) has the molecular formula C13H12O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is 5-methyl-2-phenoxyphenol.

Molecular Properties

Compound Name5-methyl-2-phenoxyphenol
PubChem CID5271322
Molecular FormulaC13H12O2
Molecular Weight200.24 g/mol
Exact Mass200.08
IUPAC Name5-methyl-2-phenoxyphenol
SMILESCc1ccc(Oc2ccccc2)c(O)c1
InChIInChI=1S/C13H12O2/c1-10-7-8-13(12(14)9-10)15-11-5-3-2-4-6-11/h2-9,14H,1H3
InChIKeyHUPPMDCSGSHZHI-UHFFFAOYSA-N
XLogP3.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-phenoxyphenol?
The IUPAC name of 5-methyl-2-phenoxyphenol (CID 5271322) is 5-methyl-2-phenoxyphenol.
What is the SMILES notation for 5-methyl-2-phenoxyphenol?
The canonical SMILES for 5-methyl-2-phenoxyphenol is Cc1ccc(Oc2ccccc2)c(O)c1.
What is the InChIKey of 5-methyl-2-phenoxyphenol?
The InChIKey is HUPPMDCSGSHZHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O2/c1-10-7-8-13(12(14)9-10)15-11-5-3-2-4-6-11/h2-9,14H,1H3.
What are the key properties of 5-methyl-2-phenoxyphenol?
5-methyl-2-phenoxyphenol has a molecular weight of 200.24 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-phenoxyphenol is sourced from PubChem (CID 5271322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).