9H-carbazole;9,10-diphenylanthracene

C38H27N — CID 159841164

IUPAC9H-carbazole;9,10-diphenylanthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C26H18.C12H9N/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-18H;1-8,13H
InChIKeyNORQOGBYLQTBSA-UHFFFAOYSA-N
MW497.64 g/mol
LogP10.65
Rot. Bonds2

About 9H-carbazole;9,10-diphenylanthracene

9H-carbazole;9,10-diphenylanthracene (PubChem CID 159841164) has the molecular formula C38H27N and a molecular weight of 497.64 g/mol. Its IUPAC name is 9H-carbazole;9,10-diphenylanthracene.

Molecular Properties

Compound Name9H-carbazole;9,10-diphenylanthracene
PubChem CID159841164
Molecular FormulaC38H27N
Molecular Weight497.64 g/mol
Exact Mass497.21
IUPAC Name9H-carbazole;9,10-diphenylanthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C26H18.C12H9N/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-18H;1-8,13H
InChIKeyNORQOGBYLQTBSA-UHFFFAOYSA-N
XLogP10.65
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.64
LogP ≤ 510.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;9,10-diphenylanthracene?
The IUPAC name of 9H-carbazole;9,10-diphenylanthracene (CID 159841164) is 9H-carbazole;9,10-diphenylanthracene.
What is the SMILES notation for 9H-carbazole;9,10-diphenylanthracene?
The canonical SMILES for 9H-carbazole;9,10-diphenylanthracene is c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 9H-carbazole;9,10-diphenylanthracene?
The InChIKey is NORQOGBYLQTBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18.C12H9N/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-18H;1-8,13H.
What are the key properties of 9H-carbazole;9,10-diphenylanthracene?
9H-carbazole;9,10-diphenylanthracene has a molecular weight of 497.64 g/mol, XLogP of 10.65, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;9,10-diphenylanthracene is sourced from PubChem (CID 159841164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).