3-Thiocyanato-1-propene
AlkaPlorer ID: AK021427
Synonym: 2-Propenyl thiocyanate, Allyl thiocyanate, Allylrhodamide
IUPAC Name: prop-2-enyl thiocyanate
Structure
SMILES: C=CCSC#N
InChI: InChI=1S/C4H5NS/c1-2-3-6-4-5/h2H,1,3H2
InChIKey: IFVYHJRLWCUVBB-UHFFFAOYSA-N
Reference
Volatile constituents occurring in autolyzed leaves of three cruciferous vegetables.
PubChem CID: 69816
CAS: 764-49-8
LOTUS: LTS0234813
SuperNatural Ⅲ: SN0144572
NPASS: NPC133313
COCONUT: CNP0391044
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erysimum cheiranthoides | Erysimum | Brassicaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 99.158
TPSA？: 23.79
MolLogP？: 1.38668
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|