1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene

C17H20O4 — CID 90709146

IUPAC1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene
SMILESCOc1c(C)c(OC)c(OC)c(-c2ccccc2)c1OC
InChIInChI=1S/C17H20O4/c1-11-14(18-2)16(20-4)13(12-9-7-6-8-10-12)17(21-5)15(11)19-3/h6-10H,1-5H3
InChIKeyGLCHZQAUGPSVFZ-UHFFFAOYSA-N
MW288.34 g/mol
LogP3.70
Rot. Bonds5

About 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene

1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene (PubChem CID 90709146) has the molecular formula C17H20O4 and a molecular weight of 288.34 g/mol. Its IUPAC name is 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene.

Molecular Properties

Compound Name1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene
PubChem CID90709146
Molecular FormulaC17H20O4
Molecular Weight288.34 g/mol
Exact Mass288.14
IUPAC Name1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene
SMILESCOc1c(C)c(OC)c(OC)c(-c2ccccc2)c1OC
InChIInChI=1S/C17H20O4/c1-11-14(18-2)16(20-4)13(12-9-7-6-8-10-12)17(21-5)15(11)19-3/h6-10H,1-5H3
InChIKeyGLCHZQAUGPSVFZ-UHFFFAOYSA-N
XLogP3.70
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-1,4-dimethyl-3,5-diphenylbenzene
CID 173306181
[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane
CID 58152974
(2-methoxy-3,4,5,6-tetraphenylphenyl)-triphenylphosphanium
CID 175447264
(3,4-dimethoxy-12-methyl-5-phenyl-11-tricyclo[5.3.1.12,6]dodeca-1(10),2,4,6(12),7(11),8-hexaenyl)methanol
CID 141218224
4-methoxy-2,3,5-trimethyl-6-phenylphenol;phosphoric acid
CID 160922447
3-methoxy-1-methyl-2-phenylnaphthalene
CID 71079447
4-methoxy-2,5-diphenylbenzene-1,3-diol
CID 53244203
ethane;1,2,3,4,5-pentamethyl-6-phenylbenzene
CID 91414507
3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol
CID 139590135
2-methoxy-1,3-diphenylbenzene
CID 23524590
9,10-diphenylanthracene;ethane;9-methyl-10-phenylanthracene
CID 143856164
2,4-dimethoxy-3-phenylaniline
CID 165495221

Frequently Asked Questions

What is the IUPAC name of 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene?
The IUPAC name of 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene (CID 90709146) is 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene.
What is the SMILES notation for 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene?
The canonical SMILES for 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene is COc1c(C)c(OC)c(OC)c(-c2ccccc2)c1OC.
What is the InChIKey of 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene?
The InChIKey is GLCHZQAUGPSVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O4/c1-11-14(18-2)16(20-4)13(12-9-7-6-8-10-12)17(21-5)15(11)19-3/h6-10H,1-5H3.
What are the key properties of 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene?
1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene has a molecular weight of 288.34 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,5-tetramethoxy-3-methyl-6-phenylbenzene is sourced from PubChem (CID 90709146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).