| 2D Structure | |
| CID | 6184 |
| Target | / , / |
| IUPAC Name | hexanal |
| InChI | InChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3 |
| InChI Key | JARKCYVAAOWBJS-UHFFFAOYSA-N |
| Canonical SMILES | CCCCCC=O |
| Isomeric SMILES | CCCCCC=O |
| Molecular Formula | C6H12O |
| Molecular Weight | 100.16 |
| synonyms | ['HEXANAL', '66-25-1', 'Hexaldehyde', 'Caproic aldehyde', '1-Hexanal', 'Capronaldehyde', 'n-Hexanal', 'Hexanaldehyde', 'n-Caproaldehyde', 'Hexylaldehyde', 'Aldehyde C-6', 'n-Capronaldehyde', 'n-Caproylaldehyde', 'Hexoic aldehyde', 'n-Hexaldehyde', 'C6 aldehyde', 'n-Caproic aldehyde', 'Kapronaldehyd', 'n-Hexylaldehyde', 'Hexanal (natural)', 'FEMA No. 2557', 'FEMA Number 2557', 'hexan-1-al', 'NSC 2596', 'CCRIS 3219', 'HSDB 560', 'n-C5H11CHO', 'UNII-9DC2K31JJQ', 'EINECS 200-624-5', '9DC2K31JJQ', 'BRN 0506198', 'DTXSID2021604', 'CHEBI:88528', 'AI3-15364', 'NSC-2596', 'DTXCID901604', 'EC 200-624-5', '4-01-00-03296 (Beilstein Handbook Reference)', 'CAPRONIC ALDEHYDE', '200-624-5', 'Caproaldehyde', 'Hexyl aldehyde', 'Aldehyde C6', 'MFCD00007027', 'CHEMBL280331', 'Kapronaldehyd [Czech]', 'CAS-66-25-1', 'UN1207', 'capronaidehyde', '1-hexanone', 'Aldehydes, C6', 'Hexanal, 98%', 'HEXANAL [FHFI]', 'HEXANAL [FCC]', 'Caproaldehyde; Hexaldehyde', 'HEXALDEHYDE [HSDB]', 'WLN: VH5', 'Hexanal, analytical standard', 'SCHEMBL22263', 'CAPROIC ALDEHYDE [MI]', 'MSK000977-1ml', 'NSC2596', 'Hexanal, natural, >=90%, FG', 'Hexanal, natural, >=95%, FG', 'Hexanal, >=97%, FCC, FG', 'Tox21_201933', 'Tox21_303342', 'BDBM50028824', 'LMFA06000109', 'STL280331', 'AKOS009156478', 'FH34397', 'FS-3948', 'Hexanal 100 microg/mL in Acetonitrile', 'UN 1207', 'NCGC00249137-01', 'NCGC00257270-01', 'NCGC00259482-01', 'BP-31180', 'DB-054893', 'H0133', 'Hexaldehyde [UN1207] [Flammable liquid]', 'NS00009211', 'EN300-33498', 'A835388', 'Q420698', 'Z234894453', '861259-78-1', 'O8Y'] |
From Pubchem