4-bromo-1-ethoxy-9H-carbazole

C14H12BrNO — CID 69306295

IUPAC4-bromo-1-ethoxy-9H-carbazole
SMILESCCOc1ccc(Br)c2c1[nH]c1ccccc12
InChIInChI=1S/C14H12BrNO/c1-2-17-12-8-7-10(15)13-9-5-3-4-6-11(9)16-14(12)13/h3-8,16H,2H2,1H3
InChIKeyHGHJPOKKRUGFDG-UHFFFAOYSA-N
MW290.16 g/mol
LogP4.48
Rot. Bonds2

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

4-bromo-1-ethoxy-9H-carbazole (PubChem CID 69306295) has the molecular formula C14H12BrNO and a molecular weight of 290.16 g/mol. Its IUPAC name is 4-bromo-1-ethoxy-9H-carbazole.

Molecular Properties

Compound Name4-bromo-1-ethoxy-9H-carbazole
PubChem CID69306295
Molecular FormulaC14H12BrNO
Molecular Weight290.16 g/mol
Exact Mass289.01
IUPAC Name4-bromo-1-ethoxy-9H-carbazole
SMILESCCOc1ccc(Br)c2c1[nH]c1ccccc12
InChIInChI=1S/C14H12BrNO/c1-2-17-12-8-7-10(15)13-9-5-3-4-6-11(9)16-14(12)13/h3-8,16H,2H2,1H3
InChIKeyHGHJPOKKRUGFDG-UHFFFAOYSA-N
XLogP4.48
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.16
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-ethoxy-9H-carbazole?
The IUPAC name of 4-bromo-1-ethoxy-9H-carbazole (CID 69306295) is 4-bromo-1-ethoxy-9H-carbazole.
What is the SMILES notation for 4-bromo-1-ethoxy-9H-carbazole?
The canonical SMILES for 4-bromo-1-ethoxy-9H-carbazole is CCOc1ccc(Br)c2c1[nH]c1ccccc12.
What is the InChIKey of 4-bromo-1-ethoxy-9H-carbazole?
The InChIKey is HGHJPOKKRUGFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrNO/c1-2-17-12-8-7-10(15)13-9-5-3-4-6-11(9)16-14(12)13/h3-8,16H,2H2,1H3.
What are the key properties of 4-bromo-1-ethoxy-9H-carbazole?
4-bromo-1-ethoxy-9H-carbazole has a molecular weight of 290.16 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-ethoxy-9H-carbazole is sourced from PubChem (CID 69306295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).