8-(1-bromoethenyl)-7-ethenylquinoline

C13H10BrN — CID 144820073

IUPAC8-(1-bromoethenyl)-7-ethenylquinoline
SMILESC=Cc1ccc2cccnc2c1C(=C)Br
InChIInChI=1S/C13H10BrN/c1-3-10-6-7-11-5-4-8-15-13(11)12(10)9(2)14/h3-8H,1-2H2
InChIKeyDYJFVMNRBQWGHB-UHFFFAOYSA-N
MW260.13 g/mol
LogP4.24
Rot. Bonds2

About 8-(1-bromoethenyl)-7-ethenylquinoline

8-(1-bromoethenyl)-7-ethenylquinoline (PubChem CID 144820073) has the molecular formula C13H10BrN and a molecular weight of 260.13 g/mol. Its IUPAC name is 8-(1-bromoethenyl)-7-ethenylquinoline.

Molecular Properties

Compound Name8-(1-bromoethenyl)-7-ethenylquinoline
PubChem CID144820073
Molecular FormulaC13H10BrN
Molecular Weight260.13 g/mol
Exact Mass259.00
IUPAC Name8-(1-bromoethenyl)-7-ethenylquinoline
SMILESC=Cc1ccc2cccnc2c1C(=C)Br
InChIInChI=1S/C13H10BrN/c1-3-10-6-7-11-5-4-8-15-13(11)12(10)9(2)14/h3-8H,1-2H2
InChIKeyDYJFVMNRBQWGHB-UHFFFAOYSA-N
XLogP4.24
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-ethenyl-8-prop-1-en-2-ylquinoline
CID 144820069
bis(1,10-phenanthroline);dihydrobromide
CID 70430219
1,10-phenanthroline;samarium
CID 174616745
iridium(3+);1,10-phenanthroline
CID 175702049
osmium;tris(1,10-phenanthroline)
CID 14251798
CID 58385596
CID 58385596
europium;1,10-phenanthroline
CID 20606755
bis(1,10-phenanthroline);ruthenium
CID 15001085
methanol;1,7-phenanthroline
CID 174496893
3-ethenyl-1,10-phenanthroline
CID 58813469
1,7-phenanthroline;dihydrochloride
CID 174688507
1,7-phenanthroline;vanadium
CID 174318955

Frequently Asked Questions

What is the IUPAC name of 8-(1-bromoethenyl)-7-ethenylquinoline?
The IUPAC name of 8-(1-bromoethenyl)-7-ethenylquinoline (CID 144820073) is 8-(1-bromoethenyl)-7-ethenylquinoline.
What is the SMILES notation for 8-(1-bromoethenyl)-7-ethenylquinoline?
The canonical SMILES for 8-(1-bromoethenyl)-7-ethenylquinoline is C=Cc1ccc2cccnc2c1C(=C)Br.
What is the InChIKey of 8-(1-bromoethenyl)-7-ethenylquinoline?
The InChIKey is DYJFVMNRBQWGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN/c1-3-10-6-7-11-5-4-8-15-13(11)12(10)9(2)14/h3-8H,1-2H2.
What are the key properties of 8-(1-bromoethenyl)-7-ethenylquinoline?
8-(1-bromoethenyl)-7-ethenylquinoline has a molecular weight of 260.13 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-bromoethenyl)-7-ethenylquinoline is sourced from PubChem (CID 144820073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).