2D Structure | |
CID | 87436 |
Target | / |
IUPAC Name | 5-isothiocyanatopent-1-ene |
InChI | InChI=1S/C6H9NS/c1-2-3-4-5-7-6-8/h2H,1,3-5H2 |
InChI Key | DBISBKDNOKIADM-UHFFFAOYSA-N |
Canonical SMILES | C=CCCCN=C=S |
Isomeric SMILES | C=CCCCN=C=S |
Molecular Formula | C6H9NS |
Molecular Weight | 127.21 |
synonyms | ['4-Pentenyl isothiocyanate', '18060-79-2', '5-isothiocyanatopent-1-ene', '1-Pentene, 5-isothiocyanato-', '5-Isothiocyanato-1-pentene', '5-isothiocyano-1-pentene', 'UNII-HL8X1CRR9B', 'HL8X1CRR9B', 'FEMA NO. 4427', 'DBISBKDNOKIADM-UHFFFAOYSA-', 'DTXSID70170986', '4-PENTENYL ISOTHIOCYANATE [FHFI]', 'ISOTHIOCYANIC ACID, 4-PENTENYL ESTER', 'DTXCID0093477', 'dbisbkdnokiadm-uhfffaoysa-n', 'inchi=1/c6h9ns/c1-2-3-4-5-7-6-8/h2h,1,3-5h2', 'Isothiocyanic Acid 4-Penten-1-yl Ester', '4-Penten-1-yl Isothiocyanate', 'CHEMBL3593943', 'MFCD00191527', 'SCHEMBL1647187', 'CHEBI:138749', 'BDBM50104734', 'NSC782922', 'AKOS025294758', 'HY-W269799', 'NSC-782922', 'BS-43918', 'PD210596', 'DB-044400', 'CS-0315092', 'I0444', 'NS00120923', 'T71958', 'Q27279987'] |
From Pubchem