HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

4-Chloro-7-methoxybenzo[g]quinoline-3-carbonitrile

HCID 9835140
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc2cc3ncc(C#N)c(Cl)c3cc2c1
InChIKey
UJGVSNNRRADGGJ-UHFFFAOYSA-N
Molecular formula
C15H9ClN2O
Average molar mass
268.7 g/mol

Names & identifiers

Preferred name
4-Chloro-7-methoxybenzo[g]quinoline-3-carbonitrile
IUPAC
4-chloro-7-methoxybenzo[g]quinoline-3-carbonitrile

Names & synonyms

SCHEMBL5254882UJGVSNNRRADGGJ-UHFFFAOYSA-N4-chloro-7-methoxybenzo[g]quinoline-3-carbonitrile

Database identifiers

PubChem CID
9835140

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
45.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
380

Related reactions

6 records
New reaction record
HRID 96088 reaction equation
HRID 96088As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 989342 reaction equation
HRID 989342As productuspto-grants-2003_10
HRID 989344 reaction equation
HRID 989344As reactantuspto-grants-2003_10
HRID 1127600 reaction equation
HRID 1127600As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 2213787 reaction equation
HRID 2213787As productuspto-grants-2006_09
HRID 2213789 reaction equation
HRID 2213789As reactantuspto-grants-2006_09

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes