1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene

C96H82O16 — CID 102019300

About 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene

1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene (PubChem CID 102019300) has the molecular formula C96H82O16 and a molecular weight of 1491.70 g/mol. Its IUPAC name is 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene.

Molecular Properties

• Compound Name: 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene
• PubChem CID: 102019300
• Molecular Formula: C96H82O16
• Molecular Weight: 1491.70 g/mol
• Exact Mass: 1490.56
• IUPAC Name: 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene
• SMILES: COc1cc2ccccc2c(-c2c(OC)c(OC)c(-c3c(OC)c(OC)c(-c4c(OC)c(OC)c(-c5c(OC)c(OC)c(-c6c(OC)c(OC)c(-c7c(OC)c(OC)c(-c8c(OC)c(OC)cc9ccccc89)c8ccccc78)c7ccccc67)c6ccccc56)c5ccccc45)c4ccccc34)c3ccccc23)c1OC
• InChI: InChI=1S/C96H82O16/c1-97-67-49-51-33-17-19-35-53(51)69(83(67)99-3)71-55-37-21-23-39-57(55)73(87(103-7)85(71)101-5)75-59-41-25-27-43-61(59)77(91(107-11)89(75)105-9)79-63-45-29-31-47-65(63)81(95(111-15)93(79)109-13)82-66-48-32-30-46-64(66)80(94(110-14)96(82)112-16)78-62-44-28-26-42-60(62)76(90(106-10)92(78)108-12)74-58-40-24-22-38-56(58)72(86(102-6)88(74)104-8)70-54-36-20-18-34-52(54)50-68(98-2)84(70)100-4/h17-50H,1-16H3
• InChIKey: RGPBCYLHHNQNHF-UHFFFAOYSA-N
• XLogP: 22.72
• TPSA: 147.68 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 23
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1491.70
LogP ≤ 5	22.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene?

The IUPAC name of 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene (CID 102019300) is 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene.

What is the SMILES notation for 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene?

The canonical SMILES for 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene is COc1cc2ccccc2c(-c2c(OC)c(OC)c(-c3c(OC)c(OC)c(-c4c(OC)c(OC)c(-c5c(OC)c(OC)c(-c6c(OC)c(OC)c(-c7c(OC)c(OC)c(-c8c(OC)c(OC)cc9ccccc89)c8ccccc78)c7ccccc67)c6ccccc56)c5ccccc45)c4ccccc34)c3ccccc23)c1OC.

What is the InChIKey of 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene?

The InChIKey is RGPBCYLHHNQNHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H82O16/c1-97-67-49-51-33-17-19-35-53(51)69(83(67)99-3)71-55-37-21-23-39-57(55)73(87(103-7)85(71)101-5)75-59-41-25-27-43-61(59)77(91(107-11)89(75)105-9)79-63-45-29-31-47-65(63)81(95(111-15)93(79)109-13)82-66-48-32-30-46-64(66)80(94(110-14)96(82)112-16)78-62-44-28-26-42-60(62)76(90(106-10)92(78)108-12)74-58-40-24-22-38-56(58)72(86(102-6)88(74)104-8)70-54-36-20-18-34-52(54)50-68(98-2)84(70)100-4/h17-50H,1-16H3.

What are the key properties of 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene?

1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene has a molecular weight of 1491.70 g/mol, XLogP of 22.72, 23 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,3-dimethoxynaphthalen-1-yl)-4-[4-[4-[4-[4-[4-(2,3-dimethoxynaphthalen-1-yl)-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalen-1-yl]-2,3-dimethoxynaphthalene is sourced from PubChem (CID 102019300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).