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

C12H6Br2ClN — CID 171793473

IUPAC1,6-dibromo-3-chloro-9H-carbazole
SMILESClc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1
InChIInChI=1S/C12H6Br2ClN/c13-6-1-2-11-8(3-6)9-4-7(15)5-10(14)12(9)16-11/h1-5,16H
InChIKeyDRBBROMRMUJSPE-UHFFFAOYSA-N
MW359.45 g/mol
LogP5.50
Rot. Bonds

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

1,6-dibromo-3-chloro-9H-carbazole (PubChem CID 171793473) has the molecular formula C12H6Br2ClN and a molecular weight of 359.45 g/mol. Its IUPAC name is 1,6-dibromo-3-chloro-9H-carbazole.

Molecular Properties

Compound Name1,6-dibromo-3-chloro-9H-carbazole
PubChem CID171793473
Molecular FormulaC12H6Br2ClN
Molecular Weight359.45 g/mol
Exact Mass356.86
IUPAC Name1,6-dibromo-3-chloro-9H-carbazole
SMILESClc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1
InChIInChI=1S/C12H6Br2ClN/c13-6-1-2-11-8(3-6)9-4-7(15)5-10(14)12(9)16-11/h1-5,16H
InChIKeyDRBBROMRMUJSPE-UHFFFAOYSA-N
XLogP5.50
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.45
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

1,6-dibromo-3-methyl-9H-carbazole
CID 171793156
6-bromo-1-chloro-9H-pyrido[3,4-b]indole
CID 115051764
1-bromo-6-chloro-N-(3,4-dichlorophenyl)-9H-carbazol-3-amine
CID 171794110
1-bromo-3,6-dimethyl-9H-carbazole
CID 155672564
3,6-dibromo-1-ethyl-9H-carbazole
CID 172559525
9H-carbazole;3,6-dibromo-9H-carbazole
CID 159453130
8-bromo-5-phenyl-11H-benzo[a]carbazole
CID 176551555
2,10-dibromo-6-(2-methoxyethoxy)-5,7-dihydroindolo[2,3-b]carbazole
CID 59238921
3,4,6-tribromo-9H-carbazol-1-ol
CID 58248320
5,14,23-trichloro-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3(8),4,6,11(19),12(17),13,15,21(26),22,24-dodecaene
CID 177401984
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
3,6-dichloro-1-(3,6-dichlorocarbazol-9-yl)-9H-carbazole
CID 122387908

Frequently Asked Questions

What is the IUPAC name of 1,6-dibromo-3-chloro-9H-carbazole?
The IUPAC name of 1,6-dibromo-3-chloro-9H-carbazole (CID 171793473) is 1,6-dibromo-3-chloro-9H-carbazole.
What is the SMILES notation for 1,6-dibromo-3-chloro-9H-carbazole?
The canonical SMILES for 1,6-dibromo-3-chloro-9H-carbazole is Clc1cc(Br)c2[nH]c3ccc(Br)cc3c2c1.
What is the InChIKey of 1,6-dibromo-3-chloro-9H-carbazole?
The InChIKey is DRBBROMRMUJSPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Br2ClN/c13-6-1-2-11-8(3-6)9-4-7(15)5-10(14)12(9)16-11/h1-5,16H.
What are the key properties of 1,6-dibromo-3-chloro-9H-carbazole?
1,6-dibromo-3-chloro-9H-carbazole has a molecular weight of 359.45 g/mol, XLogP of 5.50, 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-chloro-9H-carbazole is sourced from PubChem (CID 171793473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).