(3-phenoxyphenyl)methanol

C13H12O2 — CID 26295

IUPAC(3-phenoxyphenyl)methanol
SMILESOCc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2
InChIKeyKGANAERDZBAECK-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.97
Rot. Bonds3

About (3-phenoxyphenyl)methanol

(3-phenoxyphenyl)methanol (PubChem CID 26295) has the molecular formula C13H12O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is (3-phenoxyphenyl)methanol.

Molecular Properties

Compound Name(3-phenoxyphenyl)methanol
PubChem CID26295
Molecular FormulaC13H12O2
Molecular Weight200.24 g/mol
Exact Mass200.08
IUPAC Name(3-phenoxyphenyl)methanol
SMILESOCc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2
InChIKeyKGANAERDZBAECK-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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Frequently Asked Questions

What is the IUPAC name of (3-phenoxyphenyl)methanol?
The IUPAC name of (3-phenoxyphenyl)methanol (CID 26295) is (3-phenoxyphenyl)methanol.
What is the SMILES notation for (3-phenoxyphenyl)methanol?
The canonical SMILES for (3-phenoxyphenyl)methanol is OCc1cccc(Oc2ccccc2)c1.
What is the InChIKey of (3-phenoxyphenyl)methanol?
The InChIKey is KGANAERDZBAECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2.
What are the key properties of (3-phenoxyphenyl)methanol?
(3-phenoxyphenyl)methanol 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 (3-phenoxyphenyl)methanol is sourced from PubChem (CID 26295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).