1-bromo-4-phenyl-9H-carbazole

C18H12BrN — CID 152676128

IUPAC1-bromo-4-phenyl-9H-carbazole
SMILESBrc1ccc(-c2ccccc2)c2c1[nH]c1ccccc12
InChIInChI=1S/C18H12BrN/c19-15-11-10-13(12-6-2-1-3-7-12)17-14-8-4-5-9-16(14)20-18(15)17/h1-11,20H
InChIKeyZMODGXBUUIBUGA-UHFFFAOYSA-N
MW322.21 g/mol
LogP5.75
Rot. Bonds1

About 1-bromo-4-phenyl-9H-carbazole

1-bromo-4-phenyl-9H-carbazole (PubChem CID 152676128) has the molecular formula C18H12BrN and a molecular weight of 322.21 g/mol. Its IUPAC name is 1-bromo-4-phenyl-9H-carbazole.

Molecular Properties

Compound Name1-bromo-4-phenyl-9H-carbazole
PubChem CID152676128
Molecular FormulaC18H12BrN
Molecular Weight322.21 g/mol
Exact Mass321.02
IUPAC Name1-bromo-4-phenyl-9H-carbazole
SMILESBrc1ccc(-c2ccccc2)c2c1[nH]c1ccccc12
InChIInChI=1S/C18H12BrN/c19-15-11-10-13(12-6-2-1-3-7-12)17-14-8-4-5-9-16(14)20-18(15)17/h1-11,20H
InChIKeyZMODGXBUUIBUGA-UHFFFAOYSA-N
XLogP5.75
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.21
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

4-phenyl-9H-carbazole
CID 22990274
3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 102175677
1-(3-bromo-4-phenylphenyl)-9H-carbazole
CID 175063940
ethane;4-phenyl-9H-carbazole
CID 168948755
2-phenyl-9H-carbazol-1-ol
CID 118682381
3-phenyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2(7),3,5,8,10,12,14(19),15,17,21,23-dodecaen-18-amine
CID 164733943
6,11-diphenyl-5H-benzo[b]carbazole
CID 10785338
(2-phenyl-9H-carbazol-1-yl)boronic acid
CID 90240271
4,5-dibromo-1-phenylnaphthalene
CID 155350544
1,2,3,4-tetrabromo-9H-carbazole
CID 70631482
1-phenyl-3-(1-phenyl-9H-carbazol-3-yl)-9H-carbazole
CID 175910913
1-[4-(2-bromophenyl)phenyl]-9H-carbazole
CID 175063939

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-phenyl-9H-carbazole?
The IUPAC name of 1-bromo-4-phenyl-9H-carbazole (CID 152676128) is 1-bromo-4-phenyl-9H-carbazole.
What is the SMILES notation for 1-bromo-4-phenyl-9H-carbazole?
The canonical SMILES for 1-bromo-4-phenyl-9H-carbazole is Brc1ccc(-c2ccccc2)c2c1[nH]c1ccccc12.
What is the InChIKey of 1-bromo-4-phenyl-9H-carbazole?
The InChIKey is ZMODGXBUUIBUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12BrN/c19-15-11-10-13(12-6-2-1-3-7-12)17-14-8-4-5-9-16(14)20-18(15)17/h1-11,20H.
What are the key properties of 1-bromo-4-phenyl-9H-carbazole?
1-bromo-4-phenyl-9H-carbazole has a molecular weight of 322.21 g/mol, XLogP of 5.75, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-phenyl-9H-carbazole is sourced from PubChem (CID 152676128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).