3-chloroindole
AlkaPlorer ID: AK009249
Synonym: '16863-96-0'
IUPAC Name: 3-chloro-1H-indole
Structure
SMILES: ClC1=CNC2=CC=CC=C12
InChI: InChI=1S/C8H6ClN/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5,10H
InChIKey: GVSMQKKMAYLKMM-UHFFFAOYSA-N
Reference
3-chloroindole, principal odorous constituent of the hemichordatePtychodera flava laysanica
PubChem CID: 177790
CAS: 16863-96-0
LOTUS: LTS0159397
COCONUT: CNP0395645
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ptychodera flava | Ptychodera | Ptychoderidae | None | Enteropneusta | Hemichordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 151.59599999999998
TPSA？: 15.79
MolLogP？: 2.821300000000001
Number of H-Donors: 1
Number of H-Acceptors: 0
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|