9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole

C35H29N — CID 157409455

IUPAC9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole
SMILESCC(C)(C)c1ccc2c(c1)-c1cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc1C2
InChIInChI=1S/C35H29N/c1-35(2,3)27-17-14-26-20-25-13-12-24(21-31(25)32(26)22-27)23-15-18-28(19-16-23)36-33-10-6-4-8-29(33)30-9-5-7-11-34(30)36/h4-19,21-22H,20H2,1-3H3
InChIKeyICIPWZAYKMZTAC-UHFFFAOYSA-N
MW463.62 g/mol
LogP9.32
Rot. Bonds2

About 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole

9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole (PubChem CID 157409455) has the molecular formula C35H29N and a molecular weight of 463.62 g/mol. Its IUPAC name is 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole
PubChem CID157409455
Molecular FormulaC35H29N
Molecular Weight463.62 g/mol
Exact Mass463.23
IUPAC Name9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole
SMILESCC(C)(C)c1ccc2c(c1)-c1cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc1C2
InChIInChI=1S/C35H29N/c1-35(2,3)27-17-14-26-20-25-13-12-24(21-31(25)32(26)22-27)23-15-18-28(19-16-23)36-33-10-6-4-8-29(33)30-9-5-7-11-34(30)36/h4-19,21-22H,20H2,1-3H3
InChIKeyICIPWZAYKMZTAC-UHFFFAOYSA-N
XLogP9.32
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.62
LogP ≤ 59.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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9-[4-[6-(4-ethylphenyl)-9H-fluoren-3-yl]phenyl]carbazole
CID 159891621
2-tert-butyl-9-(4-phenylphenyl)carbazole
CID 122692449
9-(6-carbazol-9-yl-9H-fluoren-3-yl)carbazole
CID 59464809
9-(4-propylphenyl)-3-[6-[9-(4-propylphenyl)carbazol-3-yl]-9H-fluoren-3-yl]carbazole
CID 158482267
3-tert-butyl-8-carbazol-9-yl-11-phenyl-12H-indeno[2,1-a]carbazole
CID 58489632
9-[6-[3-(6-carbazol-9-yl-9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]carbazole;bis(prop-1-ene)
CID 144541446
9-[4-(9H-fluoren-3-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole
CID 159939100
3,6-ditert-butyl-9-(9H-fluoren-2-yl)carbazole
CID 158328553
9-[8-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9H-fluoren-3-yl]dibenzofuran-2-yl]carbazole
CID 143456606
3-(18-chloro-10-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaenyl)-9-phenylcarbazole
CID 146886402
3,6-ditert-butyl-9-[4-[4-(4-carbazol-9-ylphenyl)-2,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]carbazole
CID 146556924

Frequently Asked Questions

What is the IUPAC name of 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole?
The IUPAC name of 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole (CID 157409455) is 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole.
What is the SMILES notation for 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole?
The canonical SMILES for 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole is CC(C)(C)c1ccc2c(c1)-c1cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc1C2.
What is the InChIKey of 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole?
The InChIKey is ICIPWZAYKMZTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H29N/c1-35(2,3)27-17-14-26-20-25-13-12-24(21-31(25)32(26)22-27)23-15-18-28(19-16-23)36-33-10-6-4-8-29(33)30-9-5-7-11-34(30)36/h4-19,21-22H,20H2,1-3H3.
What are the key properties of 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole?
9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole has a molecular weight of 463.62 g/mol, XLogP of 9.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(6-tert-butyl-9H-fluoren-3-yl)phenyl]carbazole is sourced from PubChem (CID 157409455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).