3
3-hexanone
Chemical compound
Also known as Ethyl propyl ketone · Hexan-3-one · 3-Oxohexane
- Formula
- C₆H₁₂O
1
- C₆H₁₂O
- Mass
- 100.089 Da
1
- 100.089 Da
- Melting point
- -55°C
1
- -55°C
Chemistry
All data
42 statements · 52% with external sources · numbers in brackets are citations
- Canonical SMILES
- CCCC(=O)CC
1
- CCCC(=O)CC
On other databases
29 identifiers linking 3-hexanone across the web's reference databases
- Cannabis Database ID004863
- CAS Registry Number589-38-8
- ChEBI ID89891
- ChEMBL IDCHEMBL3184187
- ChemSpider ID11025
- CosIng number39925
- DSSTOX compound identifierDTXCID501608
- DSSTox substance IDDTXSID2021608
- EC number209-645-4
- ECHA Substance Infocard ID100.008.770
- Freebase ID/m/0t53dms
- Human Metabolome Database IDHMDB0000753
- InChIInChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3
- InChIKeyPFCHFHIRKBAQGU-UHFFFAOYSA-N
- JECFA database ID4649
- JECFA number281
- KNApSAcK IDC00052141
- LIPID MAPS IDLMFA12000049
- MassBank accession IDMSBNK-Fac_Eng_Univ_Tokyo-JP000267
- Microsoft Academic ID (discontinued)2778368874
- Natural Product Atlas IDNPA012016
- NMRShiftDB structure ID74223
- PubChem CID11509
- SPLASHsplash10-054o-9000000000-7166c2e59f557283534f
- SureChEMBL ID107318
- SwissLipids IDSLM:000597960
- UniChem compound ID17425982
- UNIIP601A79G79
- ZVG number493338