methane;1,2,3,4-tetramethoxy-5-methylbenzene

C12H20O4 — CID 157228165

IUPACmethane;1,2,3,4-tetramethoxy-5-methylbenzene
SMILESC.COc1cc(C)c(OC)c(OC)c1OC
InChIInChI=1S/C11H16O4.CH4/c1-7-6-8(12-2)10(14-4)11(15-5)9(7)13-3;/h6H,1-5H3;1H4
InChIKeyATUGTRARVLVZMC-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.67
Rot. Bonds4

About methane;1,2,3,4-tetramethoxy-5-methylbenzene

methane;1,2,3,4-tetramethoxy-5-methylbenzene (PubChem CID 157228165) has the molecular formula C12H20O4 and a molecular weight of 228.29 g/mol. Its IUPAC name is methane;1,2,3,4-tetramethoxy-5-methylbenzene.

Molecular Properties

Compound Namemethane;1,2,3,4-tetramethoxy-5-methylbenzene
PubChem CID157228165
Molecular FormulaC12H20O4
Molecular Weight228.29 g/mol
Exact Mass228.14
IUPAC Namemethane;1,2,3,4-tetramethoxy-5-methylbenzene
SMILESC.COc1cc(C)c(OC)c(OC)c1OC
InChIInChI=1S/C11H16O4.CH4/c1-7-6-8(12-2)10(14-4)11(15-5)9(7)13-3;/h6H,1-5H3;1H4
InChIKeyATUGTRARVLVZMC-UHFFFAOYSA-N
XLogP2.67
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,2,3-trimethoxy-5-methyl-4-(2,3,4-trimethoxy-6-methylphenyl)benzene
CID 20758550
4-chloro-1,2,3-trimethoxy-5-methylbenzene;ethane
CID 145244698
1-bromo-5-(5-bromo-2,3,4-trimethoxy-6-methylphenyl)-2,3,4-trimethoxy-6-methylbenzene;1,2,3-trimethoxy-5-methyl-4-(2,3,4-trimethoxy-6-methylphenyl)benzene
CID 157222020
ethane;1,2,3-trimethoxy-4-methylbenzene
CID 142152701
5-tert-butyl-1,2-dimethoxy-3-methylbenzene;ethane
CID 143060734
2,3-dimethoxy-5,6-dimethylphenol
CID 53405608
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
1-(2,3-dimethoxy-5,6-dimethylphenyl)ethanone
CID 117297608
methyl 2,3,4-trimethoxy-6-methylbenzoate
CID 59466592
2-(3,4-dimethoxy-5-methylphenyl)propan-2-ol
CID 117300512
2-bromo-5,6-dimethoxy-3-methylphenol
CID 84705992
ethane;1-methoxy-2,4,5-trimethylbenzene
CID 143418687

Frequently Asked Questions

What is the IUPAC name of methane;1,2,3,4-tetramethoxy-5-methylbenzene?
The IUPAC name of methane;1,2,3,4-tetramethoxy-5-methylbenzene (CID 157228165) is methane;1,2,3,4-tetramethoxy-5-methylbenzene.
What is the SMILES notation for methane;1,2,3,4-tetramethoxy-5-methylbenzene?
The canonical SMILES for methane;1,2,3,4-tetramethoxy-5-methylbenzene is C.COc1cc(C)c(OC)c(OC)c1OC.
What is the InChIKey of methane;1,2,3,4-tetramethoxy-5-methylbenzene?
The InChIKey is ATUGTRARVLVZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O4.CH4/c1-7-6-8(12-2)10(14-4)11(15-5)9(7)13-3;/h6H,1-5H3;1H4.
What are the key properties of methane;1,2,3,4-tetramethoxy-5-methylbenzene?
methane;1,2,3,4-tetramethoxy-5-methylbenzene has a molecular weight of 228.29 g/mol, XLogP of 2.67, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1,2,3,4-tetramethoxy-5-methylbenzene is sourced from PubChem (CID 157228165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).