2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol

C17H28O2 — CID 139823212

IUPAC2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol
SMILESCCCCc1cc(CCOCC)cc(C(C)C)c1O
InChIInChI=1S/C17H28O2/c1-5-7-8-15-11-14(9-10-19-6-2)12-16(13(3)4)17(15)18/h11-13,18H,5-10H2,1-4H3
InChIKeyAMRXRVWIUNGLFB-UHFFFAOYSA-N
MW264.41 g/mol
LogP4.44
Rot. Bonds8

About 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol

2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol (PubChem CID 139823212) has the molecular formula C17H28O2 and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol.

Molecular Properties

Compound Name2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol
PubChem CID139823212
Molecular FormulaC17H28O2
Molecular Weight264.41 g/mol
Exact Mass264.21
IUPAC Name2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol
SMILESCCCCc1cc(CCOCC)cc(C(C)C)c1O
InChIInChI=1S/C17H28O2/c1-5-7-8-15-11-14(9-10-19-6-2)12-16(13(3)4)17(15)18/h11-13,18H,5-10H2,1-4H3
InChIKeyAMRXRVWIUNGLFB-UHFFFAOYSA-N
XLogP4.44
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[2-[4-hydroxy-3,5-di(propan-2-yl)phenyl]ethoxy]ethyl]-2,6-di(propan-2-yl)phenol
CID 141231732
[3-[3-(3-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoyloxy]-2,2-bis[3-(3-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoyloxymethyl]propyl] 3-(3-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoate
CID 20544399
2,4,6-tributylphenol;zirconium(2+);dichloride
CID 174692892
2-(aminomethyl)-4,6-dibutylphenol
CID 167065415
4-butyl-2,6-didodecylphenol
CID 66619638
2-butyl-4-pentyl-6-propylphenol
CID 66878895
2,4,6-triheptylphenol
CID 139692303
2-butyl-6-ethyl-4-pentylphenol
CID 66879170
2-butyl-4-ethyl-6-propylphenol
CID 66988794
4-[2-amino-3-(3,5-dibutyl-4-hydroxyphenyl)propyl]-2,6-dibutylphenol
CID 67566752
2,6-di(butan-2-yl)-4-butylphenol
CID 66619822
2-[[bis(2-methylpropyl)amino]methyl]-4,6-di(nonyl)phenol
CID 23346787

Frequently Asked Questions

What is the IUPAC name of 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol?
The IUPAC name of 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol (CID 139823212) is 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol.
What is the SMILES notation for 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol?
The canonical SMILES for 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol is CCCCc1cc(CCOCC)cc(C(C)C)c1O.
What is the InChIKey of 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol?
The InChIKey is AMRXRVWIUNGLFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28O2/c1-5-7-8-15-11-14(9-10-19-6-2)12-16(13(3)4)17(15)18/h11-13,18H,5-10H2,1-4H3.
What are the key properties of 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol?
2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol has a molecular weight of 264.41 g/mol, XLogP of 4.44, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-4-(2-ethoxyethyl)-6-propan-2-ylphenol is sourced from PubChem (CID 139823212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).