1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol

C31H20BrNO — CID 140910477

IUPAC1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol
SMILESOC1(c2ccccc2-n2c3ccccc3c3ccccc32)c2ccccc2-c2cccc(Br)c21
InChIInChI=1S/C31H20BrNO/c32-26-16-9-13-23-20-10-1-4-14-24(20)31(34,30(23)26)25-15-5-8-19-29(25)33-27-17-6-2-11-21(27)22-12-3-7-18-28(22)33/h1-19,34H
InChIKeyUKXAPNJBEJMJDL-UHFFFAOYSA-N
MW502.41 g/mol
LogP7.81
Rot. Bonds2

About 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol

1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol (PubChem CID 140910477) has the molecular formula C31H20BrNO and a molecular weight of 502.41 g/mol. Its IUPAC name is 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol.

Molecular Properties

Compound Name1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol
PubChem CID140910477
Molecular FormulaC31H20BrNO
Molecular Weight502.41 g/mol
Exact Mass501.07
IUPAC Name1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol
SMILESOC1(c2ccccc2-n2c3ccccc3c3ccccc32)c2ccccc2-c2cccc(Br)c21
InChIInChI=1S/C31H20BrNO/c32-26-16-9-13-23-20-10-1-4-14-24(20)31(34,30(23)26)25-15-5-8-19-29(25)33-27-17-6-2-11-21(27)22-12-3-7-18-28(22)33/h1-19,34H
InChIKeyUKXAPNJBEJMJDL-UHFFFAOYSA-N
XLogP7.81
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.41
LogP ≤ 57.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-carbazol-9-ylphenyl)-2,4-bis(4-phenylphenyl)indeno[1,2-d]pyrimidin-5-ol
CID 118372596
9-(5'-carbazol-9-ylspiro[fluorene-9,9'-xanthene]-4'-yl)carbazole
CID 167178045
ethane;spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]
CID 158101812
3-(8-bromo-9,9-dimethylfluoren-2-yl)-9-phenylcarbazole
CID 142720413
9-(2-bromophenyl)carbazole;2'-bromospiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene];2'-(4-chlorophenyl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]
CID 157456859
2-[3-(3-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-1-yl)carbazole
CID 90216180
9-[2-[2,5-dibromo-6-(2-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazole
CID 156664641
3-[9-(9,9-dimethylfluoren-4-yl)carbazol-3-yl]-9-(2-phenylphenyl)carbazole
CID 146664841
2-(3-bromophenyl)-9-(9,9-dimethylfluoren-1-yl)-6-phenylcarbazole
CID 118505946
13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene
CID 12555402
9-[2-(3-bromophenyl)-6-carbazol-9-ylphenyl]carbazole
CID 169015179
9-(2-bromophenyl)pyrido[2,3-b]indole
CID 170774308

Frequently Asked Questions

What is the IUPAC name of 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol?
The IUPAC name of 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol (CID 140910477) is 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol.
What is the SMILES notation for 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol?
The canonical SMILES for 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol is OC1(c2ccccc2-n2c3ccccc3c3ccccc32)c2ccccc2-c2cccc(Br)c21.
What is the InChIKey of 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol?
The InChIKey is UKXAPNJBEJMJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H20BrNO/c32-26-16-9-13-23-20-10-1-4-14-24(20)31(34,30(23)26)25-15-5-8-19-29(25)33-27-17-6-2-11-21(27)22-12-3-7-18-28(22)33/h1-19,34H.
What are the key properties of 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol?
1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol has a molecular weight of 502.41 g/mol, XLogP of 7.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-9-(2-carbazol-9-ylphenyl)fluoren-9-ol is sourced from PubChem (CID 140910477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).