[2-(oxan-4-yloxy)phenyl]methanol

C12H16O3 — CID 22932192

IUPAC[2-(oxan-4-yloxy)phenyl]methanol
SMILESOCc1ccccc1OC1CCOCC1
InChIInChI=1S/C12H16O3/c13-9-10-3-1-2-4-12(10)15-11-5-7-14-8-6-11/h1-4,11,13H,5-9H2
InChIKeyRMRHXMQGVDIPCL-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.74
Rot. Bonds3

About [2-(oxan-4-yloxy)phenyl]methanol

[2-(oxan-4-yloxy)phenyl]methanol (PubChem CID 22932192) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is [2-(oxan-4-yloxy)phenyl]methanol.

Molecular Properties

Compound Name[2-(oxan-4-yloxy)phenyl]methanol
PubChem CID22932192
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name[2-(oxan-4-yloxy)phenyl]methanol
SMILESOCc1ccccc1OC1CCOCC1
InChIInChI=1S/C12H16O3/c13-9-10-3-1-2-4-12(10)15-11-5-7-14-8-6-11/h1-4,11,13H,5-9H2
InChIKeyRMRHXMQGVDIPCL-UHFFFAOYSA-N
XLogP1.74
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[2-(oxan-4-yloxy)phenyl]methyl]cyclopropan-1-ol
CID 117374036
[3-methyl-2-(oxan-4-yloxy)phenyl]methanol
CID 112612396
2-[2-(oxolan-3-yloxy)phenyl]acetic acid
CID 80741380
[2-methoxy-3-(oxolan-3-yloxy)phenyl]methanol
CID 84689080
1-methyl-4-[3-[2-(oxan-4-yloxy)phenyl]propyl]piperazine
CID 170863354
[3-methoxy-2-(oxolan-3-yloxy)phenyl]methanol
CID 63558981
3-methyl-3-[2-(oxan-4-yloxy)phenyl]butanoic acid
CID 117446292
N-[[2-(oxolan-3-yloxy)phenyl]methyl]cyclopropanamine
CID 63558326
3-[2-(oxan-4-yloxy)naphthalen-1-yl]prop-2-yn-1-ol
CID 63937091
3-[2-(chloromethyl)phenoxy]oxane
CID 107135119
4-phenoxyoxane
CID 58483739
2-amino-3-[2-(oxolan-3-yloxy)phenyl]propanoic acid
CID 115005094

Frequently Asked Questions

What is the IUPAC name of [2-(oxan-4-yloxy)phenyl]methanol?
The IUPAC name of [2-(oxan-4-yloxy)phenyl]methanol (CID 22932192) is [2-(oxan-4-yloxy)phenyl]methanol.
What is the SMILES notation for [2-(oxan-4-yloxy)phenyl]methanol?
The canonical SMILES for [2-(oxan-4-yloxy)phenyl]methanol is OCc1ccccc1OC1CCOCC1.
What is the InChIKey of [2-(oxan-4-yloxy)phenyl]methanol?
The InChIKey is RMRHXMQGVDIPCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O3/c13-9-10-3-1-2-4-12(10)15-11-5-7-14-8-6-11/h1-4,11,13H,5-9H2.
What are the key properties of [2-(oxan-4-yloxy)phenyl]methanol?
[2-(oxan-4-yloxy)phenyl]methanol has a molecular weight of 208.26 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(oxan-4-yloxy)phenyl]methanol is sourced from PubChem (CID 22932192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).