ethanol;methanol;1,4-xylene

C11H20O2 — CID 70196397

IUPACethanol;methanol;1,4-xylene
SMILESCCO.CO.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C2H6O.CH4O/c1-7-3-5-8(2)6-4-7;1-2-3;1-2/h3-6H,1-2H3;3H,2H2,1H3;2H,1H3
InChIKeyIFGLUIGIOWDREI-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.91
Rot. Bonds

About ethanol;methanol;1,4-xylene

ethanol;methanol;1,4-xylene (PubChem CID 70196397) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is ethanol;methanol;1,4-xylene.

Molecular Properties

Compound Nameethanol;methanol;1,4-xylene
PubChem CID70196397
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Nameethanol;methanol;1,4-xylene
SMILESCCO.CO.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C2H6O.CH4O/c1-7-3-5-8(2)6-4-7;1-2-3;1-2/h3-6H,1-2H3;3H,2H2,1H3;2H,1H3
InChIKeyIFGLUIGIOWDREI-UHFFFAOYSA-N
XLogP1.91
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethanol;methanol;1,4-xylene 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

ethane;methanol;1,4-xylene
CID 171074418
azane;ethanol;toluene
CID 131739211
ethanol;toluene;trihydrochloride
CID 175328160
1,3-dimethyl-5-(4-methylphenyl)benzene;ethanol
CID 123650314
methane;propane;1,4-xylene
CID 143560264
methane;propane;1,4-xylene
CID 160778309
molecular hydrogen;propane;1,4-xylene
CID 170763925
(4-methylphenyl)methanol
CID 138734499
2,2-bis(hydroxymethyl)propane-1,3-diol;ethanol;4-methylaniline
CID 175107774
ethanol;1-methyl-4-nitrobenzene
CID 91088173
ethanol;1-ethyl-4-methylpyridin-1-ium
CID 91117915
ethane;methanol;4-methyl-N,N-bis(4-methylphenyl)aniline
CID 143762169

Frequently Asked Questions

What is the IUPAC name of ethanol;methanol;1,4-xylene?
The IUPAC name of ethanol;methanol;1,4-xylene (CID 70196397) is ethanol;methanol;1,4-xylene.
What is the SMILES notation for ethanol;methanol;1,4-xylene?
The canonical SMILES for ethanol;methanol;1,4-xylene is CCO.CO.Cc1ccc(C)cc1.
What is the InChIKey of ethanol;methanol;1,4-xylene?
The InChIKey is IFGLUIGIOWDREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.C2H6O.CH4O/c1-7-3-5-8(2)6-4-7;1-2-3;1-2/h3-6H,1-2H3;3H,2H2,1H3;2H,1H3.
What are the key properties of ethanol;methanol;1,4-xylene?
ethanol;methanol;1,4-xylene has a molecular weight of 184.28 g/mol, XLogP of 1.91, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;methanol;1,4-xylene is sourced from PubChem (CID 70196397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).