3-octanone
chemical compound
Facts
7 properties- Instance of
- type of chemical entity
- Canonical SMILES
- CCCCCC(=O)CC[2]
- Chemical formula
- C₈H₁₆O[3]
- Found in taxon
- Nepeta nuda, Zingiber mioga, Platostoma africanum, Laggera alata, Nepeta tenuifolia, Agastache foeniculum, Elsholtzia fruticosa, Elsholtzia ciliata, Lentinula edodes, corn mint, Oyster toadfish, Perilla frutescens, Pimenta racemosa, Plakortis lita, Pleurotus ostreatus, Polygala senega, Lepechinia chamaedryoides, Tanacetum millefolium, Taxus canadensis, Thymus schimperi, Tuber borchii, Vaccinium angustifolium, Daucus carota, Agaricus bisporus, Agastache rugosa, Medicago sativa, Mentha japonica, Marchantia polymorpha, Flammulina velutipes, Tuber liyuanum, Lathyrus sativus, Clinopodium barbatum, Cannabis sativa, Ocimum gratissimum, Schizonepeta, Rosmarinus officinalis, Lepechinia chilensis, Arabidopsis thaliana, soybean, Feijoa sellowiana, Clinopodium suaveolens, Acca sellowiana, Homo sapiens, Matsutake[6][7][8][9][10][11][12][13][14][15][16][17][18][19][20][21][22][23][24][25]
- Mass
- +128.120115
- Melting point
- -23.0
🏷️ Also known as
en Octan-3-one
en 3-octanone
en 3-Oxooctane
en Amyl ethyl ketone
en EAK
en Ethyl amyl ketone [UN2271] [Flammable liquid]
en Ethyl N-amyl ketone
en Ethyl N-amylketone
en Ethyl N-pentyl ketone
en FEMA 2803
en N-Amyl ethyl ketone
en N-Octanone-3
de 3-Octanon
es 3-octanona
ja 3-オクタノン
tr 3-Oktanon
zh 3-辛酮
🔖 Identifiers · 31
- CAS Registry Number
- 106-68-3
- Cannabis Database ID
- 000274
- ChEBI ID
- 80946
- ChEMBL ID
- CHEMBL2269087
- ChemSpider ID
- 215929
- CosIng number
- 39039
- DSSTOX compound identifier
- DTXCID1021954
- DSSTox substance ID
- DTXSID3041954
- EC number
- 203-423-0
- ECHA Substance Infocard ID
- 100.003.113
- Freebase ID
- /m/010qrnjy
- HSDB ID
- 5371
Show all 31 identifiers +19
- Human Metabolome Database ID
- HMDB0031295
- InChIKey
- RHLVCLIPMVJYKS-UHFFFAOYSA-N
- JECFA database ID
- 492
- JECFA number
- 290
- KEGG ID
- C17145
- KNApSAcK ID
- C00034765
- LIPID MAPS ID
- LMFA12000055
- MassBank accession ID
- MSBNK-Fac_Eng_Univ_Tokyo-JP002578, MSBNK-Fac_Eng_Univ_Tokyo-JP007037
- Microsoft Academic ID (discontinued)
- 2779001328
- NSC number
- 60161
- PubChem CID
- 246728
- ScienceDirect topic ID
- chemistry/3-octanone
- SureChEMBL ID
- 5593
- SwissLipids ID
- SLM:000597957
- UNII
- 79173B4107
- UniChem compound ID
- 1074120
- ZVG number
- 22430
🔗 Connections
Found in taxon 35
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Summary
3-octanone is a type of chemical entity[1].