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505-55-5

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505-55-5 Structure

505-55-5 Structure
IdentificationBack Directory
[Name]

henicosanedioic acid
[CAS]

505-55-5
[Synonyms]

henicosanedioic acid
Heneicosanedioic acid
[Molecular Formula]

C21H40O4
[MDL Number]

MFCD00045934
[MOL File]

505-55-5.mol
[Molecular Weight]

356.54
Chemical PropertiesBack Directory
[Melting point ]

112-113 °C
[Boiling point ]

118-120 °C
[density ]

0.978±0.06 g/cm3(Predicted)
[pka]

4.48±0.10(Predicted)
[InChI]

InChI=1S/C21H40O4/c22-20(23)18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21(24)25/h1-19H2,(H,22,23)(H,24,25)
[InChIKey]

PWLXTFFHCFWCGG-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CCCCCCCCCCCCCCCCCCCC(O)=O
Hazard InformationBack Directory
[Definition]

ChEBI: Heneicosanedioic acid is a long-chain fatty acid.
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