1,6-dibromo-3-methyl-9H-carbazole

C13H9Br2N — CID 171793156

IUPAC1,6-dibromo-3-methyl-9H-carbazole
SMILESCc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1
InChIInChI=1S/C13H9Br2N/c1-7-4-10-9-6-8(14)2-3-12(9)16-13(10)11(15)5-7/h2-6,16H,1H3
InChIKeyYZAHTLZOHQQEOV-UHFFFAOYSA-N
MW339.03 g/mol
LogP5.15
Rot. Bonds

About 1,6-dibromo-3-methyl-9H-carbazole

1,6-dibromo-3-methyl-9H-carbazole (PubChem CID 171793156) has the molecular formula C13H9Br2N and a molecular weight of 339.03 g/mol. Its IUPAC name is 1,6-dibromo-3-methyl-9H-carbazole.

Molecular Properties

Compound Name1,6-dibromo-3-methyl-9H-carbazole
PubChem CID171793156
Molecular FormulaC13H9Br2N
Molecular Weight339.03 g/mol
Exact Mass336.91
IUPAC Name1,6-dibromo-3-methyl-9H-carbazole
SMILESCc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1
InChIInChI=1S/C13H9Br2N/c1-7-4-10-9-6-8(14)2-3-12(9)16-13(10)11(15)5-7/h2-6,16H,1H3
InChIKeyYZAHTLZOHQQEOV-UHFFFAOYSA-N
XLogP5.15
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.03
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-3,6-dimethyl-9H-carbazole
CID 155672564
1,6-dibromo-3-chloro-9H-carbazole
CID 171793473
1-chloro-3,6-dimethyl-9H-carbazole
CID 174314278
3,6-dibromo-1-ethyl-9H-carbazole
CID 172559525
1,3,6-trimethyl-9H-carbazole
CID 139213984
2,10-dibromo-6-(2-methoxyethoxy)-5,7-dihydroindolo[2,3-b]carbazole
CID 59238921
9H-carbazole;3,6-dibromo-9H-carbazole
CID 159453130
8-bromo-5-phenyl-11H-benzo[a]carbazole
CID 176551555
3,6-dimethyl-9H-carbazole
CID 144942624
10-bromo-6-methyl-7H-benzo[c]carbazole
CID 71526861
3,4,6-tribromo-9H-carbazol-1-ol
CID 58248320
6-bromo-1-chloro-9H-pyrido[3,4-b]indole
CID 115051764

Frequently Asked Questions

What is the IUPAC name of 1,6-dibromo-3-methyl-9H-carbazole?
The IUPAC name of 1,6-dibromo-3-methyl-9H-carbazole (CID 171793156) is 1,6-dibromo-3-methyl-9H-carbazole.
What is the SMILES notation for 1,6-dibromo-3-methyl-9H-carbazole?
The canonical SMILES for 1,6-dibromo-3-methyl-9H-carbazole is Cc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1.
What is the InChIKey of 1,6-dibromo-3-methyl-9H-carbazole?
The InChIKey is YZAHTLZOHQQEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2N/c1-7-4-10-9-6-8(14)2-3-12(9)16-13(10)11(15)5-7/h2-6,16H,1H3.
What are the key properties of 1,6-dibromo-3-methyl-9H-carbazole?
1,6-dibromo-3-methyl-9H-carbazole has a molecular weight of 339.03 g/mol, XLogP of 5.15, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dibromo-3-methyl-9H-carbazole is sourced from PubChem (CID 171793156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).