9-(2,5-ditert-butylphenyl)carbazole

C26H29N — CID 143599034

IUPAC9-(2,5-ditert-butylphenyl)carbazole
SMILESCC(C)(C)c1ccc(C(C)(C)C)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C26H29N/c1-25(2,3)18-15-16-21(26(4,5)6)24(17-18)27-22-13-9-7-11-19(22)20-12-8-10-14-23(20)27/h7-17H,1-6H3
InChIKeyITZZHHGWJPLJPY-UHFFFAOYSA-N
MW355.52 g/mol
LogP7.38
Rot. Bonds1

About 9-(2,5-ditert-butylphenyl)carbazole

9-(2,5-ditert-butylphenyl)carbazole (PubChem CID 143599034) has the molecular formula C26H29N and a molecular weight of 355.52 g/mol. Its IUPAC name is 9-(2,5-ditert-butylphenyl)carbazole.

Molecular Properties

Compound Name9-(2,5-ditert-butylphenyl)carbazole
PubChem CID143599034
Molecular FormulaC26H29N
Molecular Weight355.52 g/mol
Exact Mass355.23
IUPAC Name9-(2,5-ditert-butylphenyl)carbazole
SMILESCC(C)(C)c1ccc(C(C)(C)C)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C26H29N/c1-25(2,3)18-15-16-21(26(4,5)6)24(17-18)27-22-13-9-7-11-19(22)20-12-8-10-14-23(20)27/h7-17H,1-6H3
InChIKeyITZZHHGWJPLJPY-UHFFFAOYSA-N
XLogP7.38
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.52
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-(2,5-ditert-butylphenyl)carbazole;phenylsulfanylbenzene
CID 143599033
9-[2-tert-butyl-5-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 58163336
9-[2,5-bis(trifluoromethyl)phenyl]carbazole
CID 122431295
(2,5-ditert-butyl-4-carbazol-9-ylphenyl)boronic acid
CID 167442176
3-tert-butyl-9-(2-tert-butylphenyl)-6-[1-(3,4-ditert-butyl-5-carbazol-9-ylphenyl)-2-methylpropan-2-yl]carbazole
CID 167289801
9-(2-tert-butylphenyl)-3-[4-[3-[4-[9-(2-tert-butylphenyl)carbazol-3-yl]phenyl]quinoxalin-2-yl]phenyl]carbazole
CID 59702478
3,6-ditert-butyl-9-(3-carbazol-9-ylphenyl)carbazole
CID 59399108
9-[4-carbazol-9-yl-2,5-bis(trifluoromethyl)phenyl]carbazole
CID 135136219
3-(3-tert-butylcarbazol-9-yl)-6-carbazol-9-yl-9-phenylcarbazole
CID 59399314
4-(3,6-ditert-butylcarbazol-9-yl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1(31),2(32),3(8),4,6,10,12,14,16,18,20,22,25,27,29-pentadecaene
CID 177115147
9-[2-(3-methylpentan-3-yl)phenyl]carbazole
CID 143971806
4-[1-(3,6-ditert-butylcarbazol-9-yl)carbazol-9-yl]benzonitrile
CID 145345165

Frequently Asked Questions

What is the IUPAC name of 9-(2,5-ditert-butylphenyl)carbazole?
The IUPAC name of 9-(2,5-ditert-butylphenyl)carbazole (CID 143599034) is 9-(2,5-ditert-butylphenyl)carbazole.
What is the SMILES notation for 9-(2,5-ditert-butylphenyl)carbazole?
The canonical SMILES for 9-(2,5-ditert-butylphenyl)carbazole is CC(C)(C)c1ccc(C(C)(C)C)c(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 9-(2,5-ditert-butylphenyl)carbazole?
The InChIKey is ITZZHHGWJPLJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N/c1-25(2,3)18-15-16-21(26(4,5)6)24(17-18)27-22-13-9-7-11-19(22)20-12-8-10-14-23(20)27/h7-17H,1-6H3.
What are the key properties of 9-(2,5-ditert-butylphenyl)carbazole?
9-(2,5-ditert-butylphenyl)carbazole has a molecular weight of 355.52 g/mol, XLogP of 7.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,5-ditert-butylphenyl)carbazole is sourced from PubChem (CID 143599034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).