ChemicalBook--->CAS DataBase List--->17587-29-0

17587-29-0

17587-29-0 Structure

17587-29-0 Structure
IdentificationBack Directory
[Name]

3-HYDROXYHEPTANOIC ACID
[CAS]

17587-29-0
[Synonyms]

3-Hydroxyenanthic acid
3-HYDROXYHEPTANOIC ACID
rac-3-Hydroxyheptanoic Acid
3-Hydroxyheptanoic acid, 95 %
[Molecular Formula]

C7H14O3
[MDL Number]

MFCD07778469
[MOL File]

17587-29-0.mol
[Molecular Weight]

146.18
Chemical PropertiesBack Directory
[Melting point ]

40-41 °C
[Boiling point ]

273.6±23.0 °C(Predicted)
[density ]

1.070±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly), Ethyl Acetate (Slightly)
[form ]

Solid
[pka]

4.38±0.10(Predicted)
[color ]

Off-White
[InChI]

InChI=1S/C7H14O3/c1-2-3-4-6(8)5-7(9)10/h6,8H,2-5H2,1H3,(H,9,10)
[InChIKey]

OXSSIXNFGTZQMZ-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CC(O)CCCC
[LogP]

0.764 (est)
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictogramsGHS hazard pictograms
GHS05,GHS07
[Signal word ]

Danger
[Hazard statements ]

H315-H318-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P332+P313-P362-P403+P233-P405-P501
Hazard InformationBack Directory
[Uses]

rac-3-Hydroxyheptanoic acid is used as a reagent to synthesize β-hydroxy acid derivatives. ac-3-Hydroxyheptanoic acid is also found in milk, where it resulted as a product of degradation or fatty acid synthesis.
[Definition]

ChEBI: 3-hydroxyheptanoic acid is a 3-hydroxy fatty acid that is heptanoic acid in which one of the hydrogens at position 3 is replaced by a hydroxy group. It is a 3-hydroxy fatty acid and a medium-chain fatty acid. It is functionally related to a heptanoic acid.
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