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

C56H72O4 — CID 91034834

IUPAC2-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
SMILESCOc1c(C)c(C)c(C)c(C)c1-c1c(C)c(C)c(C)c(C)c1OC.COc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1-c1c(OC)c(C)c(C)c2c(C)c(C)c(C)c(C)c12
InChIInChI=1S/C34H42O2.C22H30O2/c1-15-17(3)21(7)29-27(19(15)5)23(9)25(11)33(35-13)31(29)32-30-22(8)18(4)16(2)20(6)28(30)24(10)26(12)34(32)36-14;1-11-13(3)17(7)21(23-9)19(15(11)5)20-16(6)12(2)14(4)18(8)22(20)24-10/h1-14H3;1-10H3
InChIKeyWTGTXFFWNDDBCS-UHFFFAOYSA-N
MW809.19 g/mol
LogP15.22
Rot. Bonds6

About 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

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 (PubChem CID 91034834) has the molecular formula C56H72O4 and a molecular weight of 809.19 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-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
PubChem CID91034834
Molecular FormulaC56H72O4
Molecular Weight809.19 g/mol
Exact Mass808.54
IUPAC Name2-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
SMILESCOc1c(C)c(C)c(C)c(C)c1-c1c(C)c(C)c(C)c(C)c1OC.COc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1-c1c(OC)c(C)c(C)c2c(C)c(C)c(C)c(C)c12
InChIInChI=1S/C34H42O2.C22H30O2/c1-15-17(3)21(7)29-27(19(15)5)23(9)25(11)33(35-13)31(29)32-30-22(8)18(4)16(2)20(6)28(30)24(10)26(12)34(32)36-14;1-11-13(3)17(7)21(23-9)19(15(11)5)20-16(6)12(2)14(4)18(8)22(20)24-10/h1-14H3;1-10H3
InChIKeyWTGTXFFWNDDBCS-UHFFFAOYSA-N
XLogP15.22
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500809.19
LogP ≤ 515.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is COc1c(C)c(C)c(C)c(C)c1-c1c(C)c(C)c(C)c(C)c1OC.COc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1-c1c(OC)c(C)c(C)c2c(C)c(C)c(C)c(C)c12.
What is the InChIKey of 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?
The InChIKey is WTGTXFFWNDDBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H42O2.C22H30O2/c1-15-17(3)21(7)29-27(19(15)5)23(9)25(11)33(35-13)31(29)32-30-22(8)18(4)16(2)20(6)28(30)24(10)26(12)34(32)36-14;1-11-13(3)17(7)21(23-9)19(15(11)5)20-16(6)12(2)14(4)18(8)22(20)24-10/h1-14H3;1-10H3.
What are the key properties of 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?
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 has a molecular weight of 809.19 g/mol, XLogP of 15.22, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 91034834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).