4-phenylmethoxyphenol

C13H12O2 — CID 7638

💊View drug profile → monobenzone
IUPAC4-phenylmethoxyphenol
SMILESOc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C13H12O2/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,14H,10H2
InChIKeyVYQNWZOUAUKGHI-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.97
Rot. Bonds3

About 4-phenylmethoxyphenol

4-phenylmethoxyphenol (PubChem CID 7638) has the molecular formula C13H12O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is 4-phenylmethoxyphenol.

Molecular Properties

Compound Name4-phenylmethoxyphenol
PubChem CID7638
Molecular FormulaC13H12O2
Molecular Weight200.24 g/mol
Exact Mass200.08
IUPAC Name4-phenylmethoxyphenol
SMILESOc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C13H12O2/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,14H,10H2
InChIKeyVYQNWZOUAUKGHI-UHFFFAOYSA-N
XLogP2.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Phenoxybenzyl alcohol
CID 26295
4-Ethoxyphenol
CID 12150
4,4'-Dihydroxydiphenyl ether
CID 16069
4-Phenoxyphenol
CID 13254
Xanthydrol
CID 72861
4-Hexyloxyphenol
CID 29354
Benzeneacetonitrile, alpha-hydroxy-3-phenoxy-, (alphaS)-
CID 93218
Benzene, 1,1'-oxybis[4-methyl-
CID 74098
p-Pentyloxyphenol
CID 29353
Benzyl Phenyl Ether
CID 70352
4-(Heptyloxy)phenol
CID 25641
Benzopyran
CID 9211

Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxyphenol?
The IUPAC name of 4-phenylmethoxyphenol (CID 7638) is 4-phenylmethoxyphenol.
What is the SMILES notation for 4-phenylmethoxyphenol?
The canonical SMILES for 4-phenylmethoxyphenol is Oc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 4-phenylmethoxyphenol?
The InChIKey is VYQNWZOUAUKGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O2/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,14H,10H2.
What are the key properties of 4-phenylmethoxyphenol?
4-phenylmethoxyphenol has a molecular weight of 200.24 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxyphenol is sourced from PubChem (CID 7638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).