[3-(2-methoxyethoxy)-2-methylphenyl]methanol

C11H16O3 — CID 67112208

IUPAC[3-(2-methoxyethoxy)-2-methylphenyl]methanol
SMILESCOCCOc1cccc(CO)c1C
InChIInChI=1S/C11H16O3/c1-9-10(8-12)4-3-5-11(9)14-7-6-13-2/h3-5,12H,6-8H2,1-2H3
InChIKeyUTNPYPYINYOATN-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.51
Rot. Bonds5

About [3-(2-methoxyethoxy)-2-methylphenyl]methanol

[3-(2-methoxyethoxy)-2-methylphenyl]methanol (PubChem CID 67112208) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is [3-(2-methoxyethoxy)-2-methylphenyl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyethoxy)-2-methylphenyl]methanol
PubChem CID67112208
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name[3-(2-methoxyethoxy)-2-methylphenyl]methanol
SMILESCOCCOc1cccc(CO)c1C
InChIInChI=1S/C11H16O3/c1-9-10(8-12)4-3-5-11(9)14-7-6-13-2/h3-5,12H,6-8H2,1-2H3
InChIKeyUTNPYPYINYOATN-UHFFFAOYSA-N
XLogP1.51
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(chloromethyl)-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbenzene
CID 10859628
1-(chloromethyl)-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbenzene;ethane
CID 142063314
1-[3-[2-(2-methoxyethoxy)ethoxy]-2-methylphenyl]-N,N-dimethylmethanamine
CID 143655445
3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylphenol
CID 104564323
[3-(2-methoxyethoxy)-2-methylphenyl]boronic acid
CID 131700786
(2-methyl-3-phenylmethoxyphenyl)methanol
CID 58087471
ethane;(2-methyl-3-phenylmethoxyphenyl)methanol
CID 143384106
(2-methyl-3-pent-2-enoxyphenyl)methanol
CID 175150852
[2-[2-(2-methylphenoxy)ethoxy]phenyl]methanol
CID 86767907
2-[2-[5-(2-methoxyethoxy)naphthalen-1-yl]oxyethoxy]ethanol
CID 58864087
3-[2-(2-methoxyethoxy)ethoxy]-2-methylbenzoic acid
CID 82827126
methyl 3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbenzoate
CID 11109738

Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyethoxy)-2-methylphenyl]methanol?
The IUPAC name of [3-(2-methoxyethoxy)-2-methylphenyl]methanol (CID 67112208) is [3-(2-methoxyethoxy)-2-methylphenyl]methanol.
What is the SMILES notation for [3-(2-methoxyethoxy)-2-methylphenyl]methanol?
The canonical SMILES for [3-(2-methoxyethoxy)-2-methylphenyl]methanol is COCCOc1cccc(CO)c1C.
What is the InChIKey of [3-(2-methoxyethoxy)-2-methylphenyl]methanol?
The InChIKey is UTNPYPYINYOATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3/c1-9-10(8-12)4-3-5-11(9)14-7-6-13-2/h3-5,12H,6-8H2,1-2H3.
What are the key properties of [3-(2-methoxyethoxy)-2-methylphenyl]methanol?
[3-(2-methoxyethoxy)-2-methylphenyl]methanol has a molecular weight of 196.25 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyethoxy)-2-methylphenyl]methanol is sourced from PubChem (CID 67112208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).