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21856-89-3

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21856-89-3 Structure

21856-89-3 Structure
IdentificationBack Directory
[Name]

6-hydroxyhexan-2-one
[CAS]

21856-89-3
[Synonyms]

Nsc 620043
5-Oxohexanol
EINECS 244-622-2
4-Acetyl-1-Butanol
6-Hydroxy-2-hexanone
6-hydroxyhexan-2-one
4-Acetylbutyl alcohol
6-Hydroxyhexane-2-one
2-Hexanone, 6-Hydroxy-
2-Hexanone, 6-hydroxy- (7CI,8CI,9CI)
[EINECS(EC#)]

244-622-2
[Molecular Formula]

C6H12O2
[MOL File]

21856-89-3.mol
[Molecular Weight]

116.16
Chemical PropertiesBack Directory
[Melting point ]

-3.75°C (estimate)
[Boiling point ]

212.22°C (estimate)
[density ]

0.9200
[refractive index ]

1.4300
[storage temp. ]

Storage temp. 2-8°C
[pka]

15.08±0.10(Predicted)
[Appearance]

Colorless to light yellow Liquid
[InChI]

InChI=1S/C6H12O2/c1-6(8)4-2-3-5-7/h7H,2-5H2,1H3
[InChIKey]

UALYCKSVHDYQRP-UHFFFAOYSA-N
[SMILES]

CC(=O)CCCCO
Hazard InformationBack Directory
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 35, p. 3080, 1970 DOI: 10.1021/jo00834a046
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