Basic information
- CAS
25368-54-1- Standard SMILES
CC(=O)CCCCCCO- InChIKey
UMDPPTMXBUCHCM-UHFFFAOYSA-N- Molecular formula
- C8H16O2
- Average molar mass
- 144.21 g/mol
- Monoisotopic mass
- 144.11502975
Names & identifiers
- Preferred name
- 8-Hydroxy-2-octanone
- IUPAC
- 8-hydroxyoctan-2-one
- English name
- 8-Hydroxy-2-octanone
- Molecular formula
- C8H16O2
- Molecular weight
- 144.21
Names & synonyms
8-Hydroxy-2-octanone8-hydroxyoctan-2-one8-hydroxy-octan-2-one25368-54-12-Octanone, 8-hydroxy-6Y4L7Y8EM6DTXSID201016026RefChem:107128DTXCID101474186UMDPPTMXBUCHCM-UHFFFAOYSA-NUNII-6Y4L7Y8EM6SCHEMBL2525606
Show more names
SCHEMBL2525609AKOS017982694AT41915DB-118913
Database identifiers
- CAS
25368-54-1- PubChem CID
- 537397
- DTXSID
DTXSID201016026- UNII
- 6Y4L7Y8EM6
- Nikkaji
- J2.311.530A
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 89.3
Physicochemical properties
- Boiling point
- 138 · 138-139 °C(Press: 12 Torr)
- Density
- 0.948 g/cm3 · 0.948 g/cm3
- pka
- 15.18 · 15.18±0.10(Predicted)
- FDA UNII
- 6 Y4L7Y8EM6 · 6Y4L7Y8EM6
Chemistry & industry
Suppliers8 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
天津诺康医药科技有限公司022-23989838 13810451150 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
晟斯化工科技（上海）有限公司+86 13590492756 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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