2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene

C52H38O2 — CID 11017918

IUPAC2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
SMILESCOc1ccc2ccccc2c1-c1c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1-c1c(OC)ccc2ccccc12
InChIInChI=1S/C52H38O2/c1-53-43-33-31-35-19-15-17-29-41(35)49(43)51-47(39-25-11-5-12-26-39)45(37-21-7-3-8-22-37)46(38-23-9-4-10-24-38)48(40-27-13-6-14-28-40)52(51)50-42-30-18-16-20-36(42)32-34-44(50)54-2/h3-34H,1-2H3
InChIKeyJVTMPHXOYZPKGL-UHFFFAOYSA-N
MW694.87 g/mol
LogP14.01
Rot. Bonds8

About 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene

2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene (PubChem CID 11017918) has the molecular formula C52H38O2 and a molecular weight of 694.87 g/mol. Its IUPAC name is 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene.

Molecular Properties

Compound Name2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
PubChem CID11017918
Molecular FormulaC52H38O2
Molecular Weight694.87 g/mol
Exact Mass694.29
IUPAC Name2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
SMILESCOc1ccc2ccccc2c1-c1c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1-c1c(OC)ccc2ccccc12
InChIInChI=1S/C52H38O2/c1-53-43-33-31-35-19-15-17-29-41(35)49(43)51-47(39-25-11-5-12-26-39)45(37-21-7-3-8-22-37)46(38-23-9-4-10-24-38)48(40-27-13-6-14-28-40)52(51)50-42-30-18-16-20-36(42)32-34-44(50)54-2/h3-34H,1-2H3
InChIKeyJVTMPHXOYZPKGL-UHFFFAOYSA-N
XLogP14.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500694.87
LogP ≤ 514.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

barium(2+);bis(1-(2-methoxynaphthalen-1-yl)naphthalen-2-olate)
CID 10952722
[1-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]oxyphosphane
CID 129073654
7-(2-methoxynaphthalen-1-yl)benzo[a]anthracene
CID 71619168
2-(2-methoxynaphthalen-1-yl)pyridine
CID 71446434
[1-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]-(4-methoxyphenyl)-phenylphosphane
CID 177405371
1-(2-methoxy-5,6,7,8-tetraphenylnaphthalen-1-yl)isoquinoline
CID 122217303
2-methoxy-1-(2-methoxynaphthalen-1-yl)-3-phenylmethoxynaphthalene
CID 172829442
1-(2-bromo-6-fluorophenyl)-2-methoxynaphthalene
CID 165084325
[3-methoxy-4-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]-trimethylsilane
CID 175847366
1,3-bis[1-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]-2H-benzimidazole
CID 18736755
4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline
CID 15506455
2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
CID 168858344

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene?
The IUPAC name of 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene (CID 11017918) is 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene.
What is the SMILES notation for 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene?
The canonical SMILES for 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene is COc1ccc2ccccc2c1-c1c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1-c1c(OC)ccc2ccccc12.
What is the InChIKey of 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene?
The InChIKey is JVTMPHXOYZPKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H38O2/c1-53-43-33-31-35-19-15-17-29-41(35)49(43)51-47(39-25-11-5-12-26-39)45(37-21-7-3-8-22-37)46(38-23-9-4-10-24-38)48(40-27-13-6-14-28-40)52(51)50-42-30-18-16-20-36(42)32-34-44(50)54-2/h3-34H,1-2H3.
What are the key properties of 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene?
2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene has a molecular weight of 694.87 g/mol, XLogP of 14.01, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene is sourced from PubChem (CID 11017918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).