2,4-dimethyl-6-(2-methylpropoxy)phenol

C12H18O2 — CID 171479386

IUPAC2,4-dimethyl-6-(2-methylpropoxy)phenol
SMILESCc1cc(C)c(O)c(OCC(C)C)c1
InChIInChI=1S/C12H18O2/c1-8(2)7-14-11-6-9(3)5-10(4)12(11)13/h5-6,8,13H,7H2,1-4H3
InChIKeyWPSQAQGKVRLTEC-UHFFFAOYSA-N
MW194.27 g/mol
LogP3.04
Rot. Bonds3

About 2,4-dimethyl-6-(2-methylpropoxy)phenol

2,4-dimethyl-6-(2-methylpropoxy)phenol (PubChem CID 171479386) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2,4-dimethyl-6-(2-methylpropoxy)phenol.

Molecular Properties

Compound Name2,4-dimethyl-6-(2-methylpropoxy)phenol
PubChem CID171479386
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2,4-dimethyl-6-(2-methylpropoxy)phenol
SMILESCc1cc(C)c(O)c(OCC(C)C)c1
InChIInChI=1S/C12H18O2/c1-8(2)7-14-11-6-9(3)5-10(4)12(11)13/h5-6,8,13H,7H2,1-4H3
InChIKeyWPSQAQGKVRLTEC-UHFFFAOYSA-N
XLogP3.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 174694459
CID 174694459
3,4-dimethoxy-6-methyl-2-(2-methylpropoxy)phenol
CID 86195094
3,5-dimethyl-2-(2-methylpropoxy)aniline
CID 54853227
1-fluoro-4,5-dimethyl-2-(2-methylpropoxy)benzene
CID 154939698
4-methyl-3-(2-methylpropoxy)benzohydrazide
CID 163359289
2,4,6-trimethyl-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 39418717
1-(4-chlorobutan-2-yl)-3,5-dimethyl-2-(2-methylpropoxy)benzene
CID 83942283
5-[3,5-dimethyl-2-(2-methylpropoxy)phenyl]-5-oxopentanoic acid
CID 82551889
1-amino-4-[3,5-dimethyl-2-(2-methylpropoxy)phenyl]pentan-2-ol
CID 83942386
4-methyl-2-(2-methylpropoxy)benzonitrile
CID 62302468
2-[1-(2-hydroxy-3,5-dimethylphenyl)-2-methoxyethyl]-4,6-dimethylphenol
CID 22085903
4-bromo-2-methyl-1-(2-methylpropoxy)benzene
CID 63529292

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(2-methylpropoxy)phenol?
The IUPAC name of 2,4-dimethyl-6-(2-methylpropoxy)phenol (CID 171479386) is 2,4-dimethyl-6-(2-methylpropoxy)phenol.
What is the SMILES notation for 2,4-dimethyl-6-(2-methylpropoxy)phenol?
The canonical SMILES for 2,4-dimethyl-6-(2-methylpropoxy)phenol is Cc1cc(C)c(O)c(OCC(C)C)c1.
What is the InChIKey of 2,4-dimethyl-6-(2-methylpropoxy)phenol?
The InChIKey is WPSQAQGKVRLTEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-8(2)7-14-11-6-9(3)5-10(4)12(11)13/h5-6,8,13H,7H2,1-4H3.
What are the key properties of 2,4-dimethyl-6-(2-methylpropoxy)phenol?
2,4-dimethyl-6-(2-methylpropoxy)phenol has a molecular weight of 194.27 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(2-methylpropoxy)phenol is sourced from PubChem (CID 171479386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).