2-methyl-4-phenoxyphenol

C13H12O2 — CID 23089676

IUPAC2-methyl-4-phenoxyphenol
SMILESCc1cc(Oc2ccccc2)ccc1O
InChIInChI=1S/C13H12O2/c1-10-9-12(7-8-13(10)14)15-11-5-3-2-4-6-11/h2-9,14H,1H3
InChIKeySFFXWJSLVRAIKN-UHFFFAOYSA-N
MW200.24 g/mol
LogP3.49
Rot. Bonds2

About 2-methyl-4-phenoxyphenol

2-methyl-4-phenoxyphenol (PubChem CID 23089676) has the molecular formula C13H12O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-methyl-4-phenoxyphenol.

Molecular Properties

Compound Name2-methyl-4-phenoxyphenol
PubChem CID23089676
Molecular FormulaC13H12O2
Molecular Weight200.24 g/mol
Exact Mass200.08
IUPAC Name2-methyl-4-phenoxyphenol
SMILESCc1cc(Oc2ccccc2)ccc1O
InChIInChI=1S/C13H12O2/c1-10-9-12(7-8-13(10)14)15-11-5-3-2-4-6-11/h2-9,14H,1H3
InChIKeySFFXWJSLVRAIKN-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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Related Compounds

2-iodo-4-phenoxyphenol
CID 10710201
[2-(4-hydroxy-3-methylphenoxy)phenyl]-phenylmethanone
CID 67943677
2-(4-hydroxy-3-methylphenoxy)-6-methylphenol
CID 66844209
1-(2-methyl-4-phenoxyphenyl)ethanol
CID 82264634
1-ethyl-3-phenoxybenzene;2-methylphenol
CID 142875210
4-(3-phenoxyphenoxy)-2-(trifluoromethyl)phenol
CID 21466174
2-[[2-hydroxy-5-(4-hydroxy-3-methylphenoxy)-3-methylphenyl]-(4-phenylphenyl)methyl]-4-(4-hydroxy-3-methylphenoxy)-6-methylphenol
CID 164762169
2,6-dimethyl-4-phenoxyaniline
CID 12546819
2,6-dimethyl-4-phenoxybenzenethiol
CID 71052663
2-[2-(methylamino)ethyl]-4-phenoxyphenol
CID 82552120
1-[2-hydroxy-4-(4-phenoxyphenoxy)phenyl]ethanone
CID 166874046
N-methoxy-2-methyl-4-phenoxyaniline
CID 134408976

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-phenoxyphenol?
The IUPAC name of 2-methyl-4-phenoxyphenol (CID 23089676) is 2-methyl-4-phenoxyphenol.
What is the SMILES notation for 2-methyl-4-phenoxyphenol?
The canonical SMILES for 2-methyl-4-phenoxyphenol is Cc1cc(Oc2ccccc2)ccc1O.
What is the InChIKey of 2-methyl-4-phenoxyphenol?
The InChIKey is SFFXWJSLVRAIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O2/c1-10-9-12(7-8-13(10)14)15-11-5-3-2-4-6-11/h2-9,14H,1H3.
What are the key properties of 2-methyl-4-phenoxyphenol?
2-methyl-4-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 2-methyl-4-phenoxyphenol is sourced from PubChem (CID 23089676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).