3-ethyl-2-methoxy-4-propylphenol

C12H18O2 — CID 67547848

IUPAC3-ethyl-2-methoxy-4-propylphenol
SMILESCCCc1ccc(O)c(OC)c1CC
InChIInChI=1S/C12H18O2/c1-4-6-9-7-8-11(13)12(14-3)10(9)5-2/h7-8,13H,4-6H2,1-3H3
InChIKeyJVOKVYOKLJNNGS-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.92
Rot. Bonds4

About 3-ethyl-2-methoxy-4-propylphenol

3-ethyl-2-methoxy-4-propylphenol (PubChem CID 67547848) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 3-ethyl-2-methoxy-4-propylphenol.

Molecular Properties

Compound Name3-ethyl-2-methoxy-4-propylphenol
PubChem CID67547848
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name3-ethyl-2-methoxy-4-propylphenol
SMILESCCCc1ccc(O)c(OC)c1CC
InChIInChI=1S/C12H18O2/c1-4-6-9-7-8-11(13)12(14-3)10(9)5-2/h7-8,13H,4-6H2,1-3H3
InChIKeyJVOKVYOKLJNNGS-UHFFFAOYSA-N
XLogP2.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 174529092
CID 174529092
4-(3-ethylheptyl)-3-(2-ethylhexyl)-2-methoxyphenol
CID 123669477
1-(2-ethyl-4-hydroxy-3-methoxyphenyl)ethanone
CID 147717249
3-[4-hydroxy-2-(hydroxymethyl)-3-methoxyphenyl]propanoic acid
CID 153427175
3-ethenyl-4-ethyl-2-methoxyphenol
CID 174818849
5-methoxy-2-propylphenol
CID 12836519
2-ethyl-3-methyl-1,4-dipropylbenzene
CID 155697581
2,3-bis(2,3,4-tripropylphenoxy)phenol
CID 67179385
5-hydroxy-1-(4-hydroxy-3-methoxy-2-pentylphenyl)octan-3-one
CID 162922446
2-pentyl-3,4-dipropylphenol
CID 66866454
1-(4-hydroxy-2-methoxy-3-propylphenyl)ethanone
CID 18388441
3-(2-aminoethyl)-2-methoxy-4-methylphenol
CID 117278761

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methoxy-4-propylphenol?
The IUPAC name of 3-ethyl-2-methoxy-4-propylphenol (CID 67547848) is 3-ethyl-2-methoxy-4-propylphenol.
What is the SMILES notation for 3-ethyl-2-methoxy-4-propylphenol?
The canonical SMILES for 3-ethyl-2-methoxy-4-propylphenol is CCCc1ccc(O)c(OC)c1CC.
What is the InChIKey of 3-ethyl-2-methoxy-4-propylphenol?
The InChIKey is JVOKVYOKLJNNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-4-6-9-7-8-11(13)12(14-3)10(9)5-2/h7-8,13H,4-6H2,1-3H3.
What are the key properties of 3-ethyl-2-methoxy-4-propylphenol?
3-ethyl-2-methoxy-4-propylphenol has a molecular weight of 194.27 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methoxy-4-propylphenol is sourced from PubChem (CID 67547848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).