HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Quinoline, 6,8-dibromo-2-(4-methylphenyl)-

HCID 178790601
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
860789-73-7
Standard SMILES
Cc1ccc(-c2ccc3cc(Br)cc(Br)c3n2)cc1
InChIKey
UDFDTFOOTNLCMF-UHFFFAOYSA-N
Molecular formula
C16H11Br2N
Average molar mass
377.07 g/mol

Names & identifiers

Preferred name
Quinoline, 6,8-dibromo-2-(4-methylphenyl)-
IUPAC
6,8-dibromo-2-(4-methylphenyl)quinoline
English name
Quinoline, 6,8-dibromo-2-(4-methylphenyl)-
Molecular formula
C16H11Br2N
Molecular weight
377.07

Names & synonyms

860789-73-76,8-Dibromo-2-(p-tolyl)quinolineQuinoline, 6,8-dibromo-2-(4-methylphenyl)-6,8-dibromo-2-(4-methylphenyl)quinolineMFCD03617924AKOS005084115SB727106,8-Dibromo-2-(4-methylphenyl)-quinolineF151661W-0806

Database identifiers

CAS
860789-73-7

Properties

Computed structural propertiesFilling in

XLogP
5.6
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
301

Physicochemical properties

Boiling point
462.8 · 462.8±40.0 °C(Predicted)
Density
1.634 · 1.634±0.06 g/cm3(Predicted)
pka
-0.84 · -0.84±0.30(Predicted)

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes