1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol

C11H16O3 — CID 117286314

IUPAC1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol
SMILESCOCc1ccc(OC)cc1C(C)O
InChIInChI=1S/C11H16O3/c1-8(12)11-6-10(14-3)5-4-9(11)7-13-2/h4-6,8,12H,7H2,1-3H3
InChIKeyACKHCYXHAWRJTI-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.89
Rot. Bonds4

About 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol

1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol (PubChem CID 117286314) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol
PubChem CID117286314
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol
SMILESCOCc1ccc(OC)cc1C(C)O
InChIInChI=1S/C11H16O3/c1-8(12)11-6-10(14-3)5-4-9(11)7-13-2/h4-6,8,12H,7H2,1-3H3
InChIKeyACKHCYXHAWRJTI-UHFFFAOYSA-N
XLogP1.89
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-methoxy-2-(methoxymethyl)phenyl]propan-2-ol
CID 117300552
1-(5-methoxy-2-methylphenyl)ethanol
CID 84652412
(1S)-1-(2,4-dimethoxyphenyl)ethanol
CID 25324308
1-ethyl-4-methoxy-2-(methoxymethyl)benzene
CID 143738113
2-(4-methoxy-2-propan-2-ylphenyl)acetic acid
CID 82054161
ethyl 2-hydroxy-2-[4-methoxy-2-(methoxymethyl)phenyl]acetate
CID 117388855
(1S)-1-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 102877125
(1R)-1-[2-[(2,4-dichlorophenyl)methoxy]-4-methoxyphenyl]ethanol
CID 82002286
1-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 102877123
(1S)-1-[2-[(2-fluoro-4-methoxyphenyl)methoxy]-5-methylphenyl]ethanol
CID 102877108
(2R)-1-(2,4-dimethoxyphenyl)propan-2-ol
CID 75406786
(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
CID 97009148

Frequently Asked Questions

What is the IUPAC name of 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol?
The IUPAC name of 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol (CID 117286314) is 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol.
What is the SMILES notation for 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol?
The canonical SMILES for 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol is COCc1ccc(OC)cc1C(C)O.
What is the InChIKey of 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol?
The InChIKey is ACKHCYXHAWRJTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3/c1-8(12)11-6-10(14-3)5-4-9(11)7-13-2/h4-6,8,12H,7H2,1-3H3.
What are the key properties of 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol?
1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol has a molecular weight of 196.25 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-methoxy-2-(methoxymethyl)phenyl]ethanol is sourced from PubChem (CID 117286314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).