1-(4-methoxy-2-propoxyphenyl)ethanol

C12H18O3 — CID 45157126

IUPAC1-(4-methoxy-2-propoxyphenyl)ethanol
SMILESCCCOc1cc(OC)ccc1C(C)O
InChIInChI=1S/C12H18O3/c1-4-7-15-12-8-10(14-3)5-6-11(12)9(2)13/h5-6,8-9,13H,4,7H2,1-3H3
InChIKeyQYFGEVMMZYGAQC-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.54
Rot. Bonds5

About 1-(4-methoxy-2-propoxyphenyl)ethanol

1-(4-methoxy-2-propoxyphenyl)ethanol (PubChem CID 45157126) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 1-(4-methoxy-2-propoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-methoxy-2-propoxyphenyl)ethanol
PubChem CID45157126
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name1-(4-methoxy-2-propoxyphenyl)ethanol
SMILESCCCOc1cc(OC)ccc1C(C)O
InChIInChI=1S/C12H18O3/c1-4-7-15-12-8-10(14-3)5-6-11(12)9(2)13/h5-6,8-9,13H,4,7H2,1-3H3
InChIKeyQYFGEVMMZYGAQC-UHFFFAOYSA-N
XLogP2.54
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(4-methoxy-2-pentoxyphenyl)ethanol
CID 82001094
1-(2,4-dipropoxyphenyl)ethanol
CID 82263776
1-(2-heptoxy-4-methoxyphenyl)ethanol
CID 82001545
1-[2-(2-ethoxyethoxy)-4-methoxyphenyl]ethanol
CID 82001084
(1R)-1-[2-(2-fluoroethoxy)-4-methoxyphenyl]ethanol
CID 82001883
3-[2-(1-hydroxyethyl)-5-methoxyphenoxy]propan-1-ol
CID 82001079
(1R)-1-[4-methoxy-2-(4-methylpentoxy)phenyl]ethanol
CID 83158123
(1R)-1-[2-[2-(2-hydroxyethoxy)ethoxy]-4-methoxyphenyl]ethanol
CID 82001346
methyl 3-[2-(1-hydroxyethyl)-5-methoxyphenoxy]propanoate
CID 82001396
(1R)-1-[4-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]ethanol
CID 103034207
(1S)-1-(2,4-dimethoxyphenyl)ethanol
CID 25324308
(1R)-1-(4-methyl-2-propoxyphenyl)ethanol
CID 63650759

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-propoxyphenyl)ethanol?
The IUPAC name of 1-(4-methoxy-2-propoxyphenyl)ethanol (CID 45157126) is 1-(4-methoxy-2-propoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-methoxy-2-propoxyphenyl)ethanol?
The canonical SMILES for 1-(4-methoxy-2-propoxyphenyl)ethanol is CCCOc1cc(OC)ccc1C(C)O.
What is the InChIKey of 1-(4-methoxy-2-propoxyphenyl)ethanol?
The InChIKey is QYFGEVMMZYGAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-4-7-15-12-8-10(14-3)5-6-11(12)9(2)13/h5-6,8-9,13H,4,7H2,1-3H3.
What are the key properties of 1-(4-methoxy-2-propoxyphenyl)ethanol?
1-(4-methoxy-2-propoxyphenyl)ethanol has a molecular weight of 210.27 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-propoxyphenyl)ethanol is sourced from PubChem (CID 45157126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).