anisole;ethane;methoxymethane;toluene

C20H34O2 — CID 91157363

IUPACanisole;ethane;methoxymethane;toluene
SMILESCC.CC.COC.COc1ccccc1.Cc1ccccc1
InChIInChI=1S/C7H8O.C7H8.C2H6O.2C2H6/c1-8-7-5-3-2-4-6-7;1-7-5-3-2-4-6-7;1-3-2;2*1-2/h2-6H,1H3;2-6H,1H3;1-2H3;2*1-2H3
InChIKeyQXQMUOIPXSLYTG-UHFFFAOYSA-N
MW306.49 g/mol
LogP6.01
Rot. Bonds1

About anisole;ethane;methoxymethane;toluene

anisole;ethane;methoxymethane;toluene (PubChem CID 91157363) has the molecular formula C20H34O2 and a molecular weight of 306.49 g/mol. Its IUPAC name is anisole;ethane;methoxymethane;toluene.

Molecular Properties

Compound Nameanisole;ethane;methoxymethane;toluene
PubChem CID91157363
Molecular FormulaC20H34O2
Molecular Weight306.49 g/mol
Exact Mass306.26
IUPAC Nameanisole;ethane;methoxymethane;toluene
SMILESCC.CC.COC.COc1ccccc1.Cc1ccccc1
InChIInChI=1S/C7H8O.C7H8.C2H6O.2C2H6/c1-8-7-5-3-2-4-6-7;1-7-5-3-2-4-6-7;1-3-2;2*1-2/h2-6H,1H3;2-6H,1H3;1-2H3;2*1-2H3
InChIKeyQXQMUOIPXSLYTG-UHFFFAOYSA-N
XLogP6.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.49
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze anisole;ethane;methoxymethane;toluene 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

anisole;ethane;methane;toluene
CID 162203446
anisole;carbanide;ethane;methoxymethane;yttrium
CID 162198050
anisole;ethane;ethylbenzene;toluene
CID 91215230
anisole;trihydrofluoride
CID 174796385
CID 172685187
CID 172685187
anisole;hydrochloride
CID 158800007
benzene;ethane;methoxymethane;propane;toluene
CID 91405943
benzene;ethane;formaldehyde;methoxymethane;toluene
CID 161142261
acetylene;anisole
CID 86033716
anisole;1-phenylethanone;toluene
CID 157308620
ethane;toluene
CID 91350799
benzene;ethane;toluene
CID 158929596

Frequently Asked Questions

What is the IUPAC name of anisole;ethane;methoxymethane;toluene?
The IUPAC name of anisole;ethane;methoxymethane;toluene (CID 91157363) is anisole;ethane;methoxymethane;toluene.
What is the SMILES notation for anisole;ethane;methoxymethane;toluene?
The canonical SMILES for anisole;ethane;methoxymethane;toluene is CC.CC.COC.COc1ccccc1.Cc1ccccc1.
What is the InChIKey of anisole;ethane;methoxymethane;toluene?
The InChIKey is QXQMUOIPXSLYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O.C7H8.C2H6O.2C2H6/c1-8-7-5-3-2-4-6-7;1-7-5-3-2-4-6-7;1-3-2;2*1-2/h2-6H,1H3;2-6H,1H3;1-2H3;2*1-2H3.
What are the key properties of anisole;ethane;methoxymethane;toluene?
anisole;ethane;methoxymethane;toluene has a molecular weight of 306.49 g/mol, XLogP of 6.01, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for anisole;ethane;methoxymethane;toluene is sourced from PubChem (CID 91157363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).