2-methyl-3-(oxolan-3-yloxy)phenol

C11H14O3 — CID 63556982

IUPAC2-methyl-3-(oxolan-3-yloxy)phenol
SMILESCc1c(O)cccc1OC1CCOC1
InChIInChI=1S/C11H14O3/c1-8-10(12)3-2-4-11(8)14-9-5-6-13-7-9/h2-4,9,12H,5-7H2,1H3
InChIKeyZBNWTJXLTKBSFQ-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.87
Rot. Bonds2

About 2-methyl-3-(oxolan-3-yloxy)phenol

2-methyl-3-(oxolan-3-yloxy)phenol (PubChem CID 63556982) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-methyl-3-(oxolan-3-yloxy)phenol.

Molecular Properties

Compound Name2-methyl-3-(oxolan-3-yloxy)phenol
PubChem CID63556982
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name2-methyl-3-(oxolan-3-yloxy)phenol
SMILESCc1c(O)cccc1OC1CCOC1
InChIInChI=1S/C11H14O3/c1-8-10(12)3-2-4-11(8)14-9-5-6-13-7-9/h2-4,9,12H,5-7H2,1H3
InChIKeyZBNWTJXLTKBSFQ-UHFFFAOYSA-N
XLogP1.87
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(oxan-3-yloxy)phenol
CID 107135241
methyl 2-hydroxy-6-[(3R)-oxolan-3-yl]oxybenzoate
CID 66746226
(3S)-3-(2-methoxyphenoxy)oxolane
CID 141103497
2-amino-3-(oxan-3-yloxy)phenol
CID 107134115
1-[2-(oxolan-3-yloxy)phenyl]ethanol
CID 63558983
[2-methoxy-3-(oxolan-3-yloxy)phenyl]methanol
CID 84689080
1-[2-(oxolan-3-yloxy)phenyl]cyclopropan-1-ol
CID 117314326
1-(3-bromo-2-methylphenyl)-3-[2-[(3R)-oxolan-3-yl]oxyphenyl]urea
CID 96542046
2-bromo-N'-hydroxy-6-(oxolan-3-yloxy)benzenecarboximidamide
CID 114883519
2-chloro-N'-hydroxy-6-(oxolan-3-yloxy)benzenecarboximidamide
CID 55213919
2-methyl-2-[2-(oxolan-3-yloxy)phenyl]propan-1-ol
CID 117345311
2-amino-3-(oxolan-3-yloxy)benzoic acid
CID 115547271

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(oxolan-3-yloxy)phenol?
The IUPAC name of 2-methyl-3-(oxolan-3-yloxy)phenol (CID 63556982) is 2-methyl-3-(oxolan-3-yloxy)phenol.
What is the SMILES notation for 2-methyl-3-(oxolan-3-yloxy)phenol?
The canonical SMILES for 2-methyl-3-(oxolan-3-yloxy)phenol is Cc1c(O)cccc1OC1CCOC1.
What is the InChIKey of 2-methyl-3-(oxolan-3-yloxy)phenol?
The InChIKey is ZBNWTJXLTKBSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-8-10(12)3-2-4-11(8)14-9-5-6-13-7-9/h2-4,9,12H,5-7H2,1H3.
What are the key properties of 2-methyl-3-(oxolan-3-yloxy)phenol?
2-methyl-3-(oxolan-3-yloxy)phenol has a molecular weight of 194.23 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(oxolan-3-yloxy)phenol is sourced from PubChem (CID 63556982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).