methane;1-methoxy-2,3,4,5,6-pentamethylbenzene

C14H26O — CID 157181904

IUPACmethane;1-methoxy-2,3,4,5,6-pentamethylbenzene
SMILESC.C.COc1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C12H18O.2CH4/c1-7-8(2)10(4)12(13-6)11(5)9(7)3;;/h1-6H3;2*1H4
InChIKeyAOQVZIDBVNBHCY-UHFFFAOYSA-N
MW210.36 g/mol
LogP4.51
Rot. Bonds1

About methane;1-methoxy-2,3,4,5,6-pentamethylbenzene

methane;1-methoxy-2,3,4,5,6-pentamethylbenzene (PubChem CID 157181904) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is methane;1-methoxy-2,3,4,5,6-pentamethylbenzene.

Molecular Properties

Compound Namemethane;1-methoxy-2,3,4,5,6-pentamethylbenzene
PubChem CID157181904
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Namemethane;1-methoxy-2,3,4,5,6-pentamethylbenzene
SMILESC.C.COc1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C12H18O.2CH4/c1-7-8(2)10(4)12(13-6)11(5)9(7)3;;/h1-6H3;2*1H4
InChIKeyAOQVZIDBVNBHCY-UHFFFAOYSA-N
XLogP4.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(methoxymethoxy)-2,3,4,5,6-pentamethylbenzene;1-methoxy-2,3,4,5,6-pentamethylbenzene
CID 91426597
1-iodo-2,5-dimethoxy-3,4,6-trimethylbenzene
CID 11822906
2-methoxy-1-(2-methoxy-3,4,5,6,7,8-hexamethylnaphthalen-1-yl)-3,4,5,6,7,8-hexamethylnaphthalene;1-methoxy-2-(2-methoxy-3,4,5,6-tetramethylphenyl)-3,4,5,6-tetramethylbenzene
CID 91034834
1-methoxy-2,3,4,6-tetramethyl-5-nitrobenzene
CID 20644944
1-(chloromethyl)-2,5-dimethoxy-3,4,6-trimethylbenzene
CID 10878929
(2,5-dimethoxy-3,4,6-trimethylphenyl)methanamine
CID 139777100
1,2,3,4,5,6-hexamethylbenzene;methane
CID 159570864
2-chloro-5-methoxy-3,4,6-trimethylaniline
CID 10655623
4-methoxy-2,5,6-trimethylbenzene-1,3-diol
CID 154393157
2-methoxy-4,6-dimethylbenzene-1,3,5-triol
CID 86718657
2,4,6-trimethoxybenzene-1,3,5-triol
CID 102382483
1,2,3,4,5,6-hexamethylbenzene;ruthenium;dihydroiodide
CID 159746066

Frequently Asked Questions

What is the IUPAC name of methane;1-methoxy-2,3,4,5,6-pentamethylbenzene?
The IUPAC name of methane;1-methoxy-2,3,4,5,6-pentamethylbenzene (CID 157181904) is methane;1-methoxy-2,3,4,5,6-pentamethylbenzene.
What is the SMILES notation for methane;1-methoxy-2,3,4,5,6-pentamethylbenzene?
The canonical SMILES for methane;1-methoxy-2,3,4,5,6-pentamethylbenzene is C.C.COc1c(C)c(C)c(C)c(C)c1C.
What is the InChIKey of methane;1-methoxy-2,3,4,5,6-pentamethylbenzene?
The InChIKey is AOQVZIDBVNBHCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O.2CH4/c1-7-8(2)10(4)12(13-6)11(5)9(7)3;;/h1-6H3;2*1H4.
What are the key properties of methane;1-methoxy-2,3,4,5,6-pentamethylbenzene?
methane;1-methoxy-2,3,4,5,6-pentamethylbenzene has a molecular weight of 210.36 g/mol, XLogP of 4.51, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methoxy-2,3,4,5,6-pentamethylbenzene is sourced from PubChem (CID 157181904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).