9-(4-tritylphenyl)carbazole

C37H27N — CID 162500226

IUPAC9-(4-tritylphenyl)carbazole
SMILESc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C37H27N/c1-4-14-28(15-5-1)37(29-16-6-2-7-17-29,30-18-8-3-9-19-30)31-24-26-32(27-25-31)38-35-22-12-10-20-33(35)34-21-11-13-23-36(34)38/h1-27H
InChIKeyJXJYRYJXSOAMJZ-UHFFFAOYSA-N
MW485.63 g/mol
LogP9.17
Rot. Bonds5

About 9-(4-tritylphenyl)carbazole

9-(4-tritylphenyl)carbazole (PubChem CID 162500226) has the molecular formula C37H27N and a molecular weight of 485.63 g/mol. Its IUPAC name is 9-(4-tritylphenyl)carbazole.

Molecular Properties

Compound Name9-(4-tritylphenyl)carbazole
PubChem CID162500226
Molecular FormulaC37H27N
Molecular Weight485.63 g/mol
Exact Mass485.21
IUPAC Name9-(4-tritylphenyl)carbazole
SMILESc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C37H27N/c1-4-14-28(15-5-1)37(29-16-6-2-7-17-29,30-18-8-3-9-19-30)31-24-26-32(27-25-31)38-35-22-12-10-20-33(35)34-21-11-13-23-36(34)38/h1-27H
InChIKeyJXJYRYJXSOAMJZ-UHFFFAOYSA-N
XLogP9.17
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.63
LogP ≤ 59.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-(4-tritylphenyl)carbazole?
The IUPAC name of 9-(4-tritylphenyl)carbazole (CID 162500226) is 9-(4-tritylphenyl)carbazole.
What is the SMILES notation for 9-(4-tritylphenyl)carbazole?
The canonical SMILES for 9-(4-tritylphenyl)carbazole is c1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of 9-(4-tritylphenyl)carbazole?
The InChIKey is JXJYRYJXSOAMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27N/c1-4-14-28(15-5-1)37(29-16-6-2-7-17-29,30-18-8-3-9-19-30)31-24-26-32(27-25-31)38-35-22-12-10-20-33(35)34-21-11-13-23-36(34)38/h1-27H.
What are the key properties of 9-(4-tritylphenyl)carbazole?
9-(4-tritylphenyl)carbazole has a molecular weight of 485.63 g/mol, XLogP of 9.17, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tritylphenyl)carbazole is sourced from PubChem (CID 162500226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).