9H-carbazole;3,6-dibromo-9H-carbazole

C24H16Br2N2 — CID 159453130

IUPAC9H-carbazole;3,6-dibromo-9H-carbazole
SMILESBrc1ccc2[nH]c3ccc(Br)cc3c2c1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H7Br2N.C12H9N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-6,15H;1-8,13H
InChIKeyLTQBKGOAQREZMS-UHFFFAOYSA-N
MW492.21 g/mol
LogP8.17
Rot. Bonds

About 9H-carbazole;3,6-dibromo-9H-carbazole

9H-carbazole;3,6-dibromo-9H-carbazole (PubChem CID 159453130) has the molecular formula C24H16Br2N2 and a molecular weight of 492.21 g/mol. Its IUPAC name is 9H-carbazole;3,6-dibromo-9H-carbazole.

Molecular Properties

Compound Name9H-carbazole;3,6-dibromo-9H-carbazole
PubChem CID159453130
Molecular FormulaC24H16Br2N2
Molecular Weight492.21 g/mol
Exact Mass489.97
IUPAC Name9H-carbazole;3,6-dibromo-9H-carbazole
SMILESBrc1ccc2[nH]c3ccc(Br)cc3c2c1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H7Br2N.C12H9N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-6,15H;1-8,13H
InChIKeyLTQBKGOAQREZMS-UHFFFAOYSA-N
XLogP8.17
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.21
LogP ≤ 58.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

6-bromo-2-phenyl-9H-carbazole
CID 118493011
2-[2-bromo-10-(9H-carbazol-2-yl)anthracen-9-yl]-9H-carbazole
CID 171477204
7,17,24,34-tetrazanonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1(20),2,4(16),5,8,10,12,14,18,21(33),22,25,27,29,31-pentadecaene
CID 58471811
9H-carbazole
CID 66668984
bromomethane;9H-carbazole
CID 67594562
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
17-bromo-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 88867954
9H-carbazole;9H-carbazole-3,6-diamine
CID 161182207
8-bromo-5-phenyl-11H-benzo[a]carbazole
CID 176551555
9H-carbazole;ethane
CID 91098062
bis(9H-carbazole);ethane
CID 145072085

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;3,6-dibromo-9H-carbazole?
The IUPAC name of 9H-carbazole;3,6-dibromo-9H-carbazole (CID 159453130) is 9H-carbazole;3,6-dibromo-9H-carbazole.
What is the SMILES notation for 9H-carbazole;3,6-dibromo-9H-carbazole?
The canonical SMILES for 9H-carbazole;3,6-dibromo-9H-carbazole is Brc1ccc2[nH]c3ccc(Br)cc3c2c1.c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 9H-carbazole;3,6-dibromo-9H-carbazole?
The InChIKey is LTQBKGOAQREZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Br2N.C12H9N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-6,15H;1-8,13H.
What are the key properties of 9H-carbazole;3,6-dibromo-9H-carbazole?
9H-carbazole;3,6-dibromo-9H-carbazole has a molecular weight of 492.21 g/mol, XLogP of 8.17, 0 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;3,6-dibromo-9H-carbazole is sourced from PubChem (CID 159453130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).