9-ethyl-3-tritylcarbazole

C33H27N — CID 91743871

IUPAC9-ethyl-3-tritylcarbazole
SMILESCCn1c2ccccc2c2cc(C(c3ccccc3)(c3ccccc3)c3ccccc3)ccc21
InChIInChI=1S/C33H27N/c1-2-34-31-21-13-12-20-29(31)30-24-28(22-23-32(30)34)33(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-24H,2H2,1H3
InChIKeyKBSRQSZJXFDZNM-UHFFFAOYSA-N
MW437.59 g/mol
LogP8.20
Rot. Bonds5

About 9-ethyl-3-tritylcarbazole

9-ethyl-3-tritylcarbazole (PubChem CID 91743871) has the molecular formula C33H27N and a molecular weight of 437.59 g/mol. Its IUPAC name is 9-ethyl-3-tritylcarbazole.

Molecular Properties

Compound Name9-ethyl-3-tritylcarbazole
PubChem CID91743871
Molecular FormulaC33H27N
Molecular Weight437.59 g/mol
Exact Mass437.21
IUPAC Name9-ethyl-3-tritylcarbazole
SMILESCCn1c2ccccc2c2cc(C(c3ccccc3)(c3ccccc3)c3ccccc3)ccc21
InChIInChI=1S/C33H27N/c1-2-34-31-21-13-12-20-29(31)30-24-28(22-23-32(30)34)33(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-24H,2H2,1H3
InChIKeyKBSRQSZJXFDZNM-UHFFFAOYSA-N
XLogP8.20
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.59
LogP ≤ 58.20
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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Related Compounds

9-[3,5-di(carbazol-9-yl)phenyl]-3-tritylcarbazole
CID 59399865
3-(9,9-diphenyl-7-tritylfluoren-2-yl)-9-ethylcarbazole
CID 59221341
9-phenyl-3-(3-tritylcarbazol-9-yl)carbazole
CID 164756650
9-ethylcarbazole-3-carboxylic acid
CID 4912869
3-carbazol-9-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-6-tritylcarbazole
CID 164756654
(9-ethylcarbazol-3-yl)-trimethylstannane
CID 71421811
9-ethyl-3-[(E)-2-(9-ethylcarbazol-3-yl)-1,2-diphenylethenyl]carbazole
CID 102220131
3-tert-butyl-9-[3-(3-carbazol-9-ylphenyl)phenyl]-6-tritylcarbazole
CID 142391271
3-tert-butyl-6,9-diethylcarbazole
CID 143233690
3-[4-[4-(2,6-ditert-butyl-10-phenylanthracen-9-yl)phenyl]phenyl]-9-ethyl-6-phenylcarbazole;3-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethyl-6-phenylcarbazole
CID 159993393
3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole
CID 158234538
9-ethyl-2-methylcarbazole
CID 19788789

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-tritylcarbazole?
The IUPAC name of 9-ethyl-3-tritylcarbazole (CID 91743871) is 9-ethyl-3-tritylcarbazole.
What is the SMILES notation for 9-ethyl-3-tritylcarbazole?
The canonical SMILES for 9-ethyl-3-tritylcarbazole is CCn1c2ccccc2c2cc(C(c3ccccc3)(c3ccccc3)c3ccccc3)ccc21.
What is the InChIKey of 9-ethyl-3-tritylcarbazole?
The InChIKey is KBSRQSZJXFDZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27N/c1-2-34-31-21-13-12-20-29(31)30-24-28(22-23-32(30)34)33(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-24H,2H2,1H3.
What are the key properties of 9-ethyl-3-tritylcarbazole?
9-ethyl-3-tritylcarbazole has a molecular weight of 437.59 g/mol, XLogP of 8.20, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-tritylcarbazole is sourced from PubChem (CID 91743871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).