2-butyl-6-methoxyphenol;4-methoxyphenol

C18H24O4 — CID 174399923

IUPAC2-butyl-6-methoxyphenol;4-methoxyphenol
SMILESCCCCc1cccc(OC)c1O.COc1ccc(O)cc1
InChIInChI=1S/C11H16O2.C7H8O2/c1-3-4-6-9-7-5-8-10(13-2)11(9)12;1-9-7-4-2-6(8)3-5-7/h5,7-8,12H,3-4,6H2,1-2H3;2-5,8H,1H3
InChIKeyXEBLWSOJWYTGCH-UHFFFAOYSA-N
MW304.39 g/mol
LogP4.14
Rot. Bonds5

About 2-butyl-6-methoxyphenol;4-methoxyphenol

2-butyl-6-methoxyphenol;4-methoxyphenol (PubChem CID 174399923) has the molecular formula C18H24O4 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-butyl-6-methoxyphenol;4-methoxyphenol.

Molecular Properties

Compound Name2-butyl-6-methoxyphenol;4-methoxyphenol
PubChem CID174399923
Molecular FormulaC18H24O4
Molecular Weight304.39 g/mol
Exact Mass304.17
IUPAC Name2-butyl-6-methoxyphenol;4-methoxyphenol
SMILESCCCCc1cccc(OC)c1O.COc1ccc(O)cc1
InChIInChI=1S/C11H16O2.C7H8O2/c1-3-4-6-9-7-5-8-10(13-2)11(9)12;1-9-7-4-2-6(8)3-5-7/h5,7-8,12H,3-4,6H2,1-2H3;2-5,8H,1H3
InChIKeyXEBLWSOJWYTGCH-UHFFFAOYSA-N
XLogP4.14
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-butyl-6-methoxyphenol;4-methoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-heptadecyl-6-methoxyphenol
CID 10713705
ethane;2-methoxy-6-propylphenol
CID 142869062
2-butyl-6-(3-butyl-2-hydroxyphenoxy)phenol
CID 171777158
(3-butyl-2-hydroxyphenyl) hydrogen carbonate
CID 69349391
2-ethoxy-6-heptadecylphenol
CID 10499794
3-(2-hydroxy-3-methoxyphenyl)propyl thiocyanate
CID 112718411
2,4-dimethoxy-6-pentylphenol
CID 13197794
2,6-di(nonyl)phenol;4-methylphenol
CID 159290402
2-methoxy-6-(phosphanylmethyl)phenol
CID 155024507
1-methoxy-2-(2-methoxy-6-octylphenyl)-3-octylbenzene
CID 15849833
2-butyl-7-methoxycyclohepta-2,4,6-trien-1-one
CID 162445839
2-butyl-1,3-dimethoxybenzene
CID 524840

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-methoxyphenol;4-methoxyphenol?
The IUPAC name of 2-butyl-6-methoxyphenol;4-methoxyphenol (CID 174399923) is 2-butyl-6-methoxyphenol;4-methoxyphenol.
What is the SMILES notation for 2-butyl-6-methoxyphenol;4-methoxyphenol?
The canonical SMILES for 2-butyl-6-methoxyphenol;4-methoxyphenol is CCCCc1cccc(OC)c1O.COc1ccc(O)cc1.
What is the InChIKey of 2-butyl-6-methoxyphenol;4-methoxyphenol?
The InChIKey is XEBLWSOJWYTGCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2.C7H8O2/c1-3-4-6-9-7-5-8-10(13-2)11(9)12;1-9-7-4-2-6(8)3-5-7/h5,7-8,12H,3-4,6H2,1-2H3;2-5,8H,1H3.
What are the key properties of 2-butyl-6-methoxyphenol;4-methoxyphenol?
2-butyl-6-methoxyphenol;4-methoxyphenol has a molecular weight of 304.39 g/mol, XLogP of 4.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-methoxyphenol;4-methoxyphenol is sourced from PubChem (CID 174399923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).