[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol

C12H16O3 — CID 28562688

IUPAC[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol
SMILESOCc1ccccc1OC[C@@H]1CCCO1
InChIInChI=1S/C12H16O3/c13-8-10-4-1-2-6-12(10)15-9-11-5-3-7-14-11/h1-2,4,6,11,13H,3,5,7-9H2/t11-/m0/s1
InChIKeyIGKCJUNAEKKZBU-NSHDSACASA-N
MW208.26 g/mol
LogP1.74
Rot. Bonds4

About [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol

[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol (PubChem CID 28562688) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol.

Molecular Properties

Compound Name[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol
PubChem CID28562688
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol
SMILESOCc1ccccc1OC[C@@H]1CCCO1
InChIInChI=1S/C12H16O3/c13-8-10-4-1-2-6-12(10)15-9-11-5-3-7-14-11/h1-2,4,6,11,13H,3,5,7-9H2/t11-/m0/s1
InChIKeyIGKCJUNAEKKZBU-NSHDSACASA-N
XLogP1.74
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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

[3-methoxy-2-(oxolan-2-ylmethoxy)phenyl]methanol
CID 43471574
[2-(1,3-dioxolan-4-ylmethoxy)phenyl]methanol
CID 86810362
2,2-dimethyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]methyl]propan-1-amine
CID 54805225
2-methyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]methyl]propan-1-amine
CID 63063949
[2-(cyclobutylmethoxy)phenyl]methanol
CID 58083532
2-(oxolan-2-ylmethoxy)benzamide
CID 24633130
[5-methoxy-2-(oxan-2-ylmethoxy)phenyl]methanol
CID 43591968
[5-[2-(oxolan-2-ylmethoxy)phenyl]-1,2-oxazol-3-yl]methanol
CID 54847413
potassium trifluoro-[2-(oxolan-2-ylmethoxy)phenyl]boranuide
CID 63676632
[2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)phenyl]methanol
CID 102898603
[4-methoxy-2-(oxan-2-ylmethoxy)phenyl]methanol
CID 61267945
2-(2-methylphenyl)-N-[[2-(oxolan-2-ylmethoxy)phenyl]methyl]ethanamine
CID 54807643

Frequently Asked Questions

What is the IUPAC name of [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol?
The IUPAC name of [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol (CID 28562688) is [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol.
What is the SMILES notation for [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol?
The canonical SMILES for [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol is OCc1ccccc1OC[C@@H]1CCCO1.
What is the InChIKey of [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol?
The InChIKey is IGKCJUNAEKKZBU-NSHDSACASA-N. The full InChI is InChI=1S/C12H16O3/c13-8-10-4-1-2-6-12(10)15-9-11-5-3-7-14-11/h1-2,4,6,11,13H,3,5,7-9H2/t11-/m0/s1.
What are the key properties of [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol?
[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol has a molecular weight of 208.26 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol is sourced from PubChem (CID 28562688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).