9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene

C28H22O2 — CID 11523963

IUPAC9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene
SMILESCOc1ccc(-c2c3ccccc3c(-c3ccccc3OC)c3ccccc23)cc1
InChIInChI=1S/C28H22O2/c1-29-20-17-15-19(16-18-20)27-21-9-3-5-11-23(21)28(24-12-6-4-10-22(24)27)25-13-7-8-14-26(25)30-2/h3-18H,1-2H3
InChIKeyUBPQDGPCLRNJGM-UHFFFAOYSA-N
MW390.48 g/mol
LogP7.34
Rot. Bonds4

About 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene

9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene (PubChem CID 11523963) has the molecular formula C28H22O2 and a molecular weight of 390.48 g/mol. Its IUPAC name is 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene.

Molecular Properties

Compound Name9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene
PubChem CID11523963
Molecular FormulaC28H22O2
Molecular Weight390.48 g/mol
Exact Mass390.16
IUPAC Name9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene
SMILESCOc1ccc(-c2c3ccccc3c(-c3ccccc3OC)c3ccccc23)cc1
InChIInChI=1S/C28H22O2/c1-29-20-17-15-19(16-18-20)27-21-9-3-5-11-23(21)28(24-12-6-4-10-22(24)27)25-13-7-8-14-26(25)30-2/h3-18H,1-2H3
InChIKeyUBPQDGPCLRNJGM-UHFFFAOYSA-N
XLogP7.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.48
LogP ≤ 57.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene?
The IUPAC name of 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene (CID 11523963) is 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene.
What is the SMILES notation for 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene?
The canonical SMILES for 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene is COc1ccc(-c2c3ccccc3c(-c3ccccc3OC)c3ccccc23)cc1.
What is the InChIKey of 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene?
The InChIKey is UBPQDGPCLRNJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22O2/c1-29-20-17-15-19(16-18-20)27-21-9-3-5-11-23(21)28(24-12-6-4-10-22(24)27)25-13-7-8-14-26(25)30-2/h3-18H,1-2H3.
What are the key properties of 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene?
9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene has a molecular weight of 390.48 g/mol, XLogP of 7.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methoxyphenyl)-10-(4-methoxyphenyl)anthracene is sourced from PubChem (CID 11523963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).