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2-Ketosuberate
[CAS# 96406-05-2]

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CAS#: 96406-05-2
Product: 2-Ketosuberate
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Identification
Name 2-Ketosuberate
Synonyms 2-Ketosuberic Acid; Octanedioic Acid, 2-Oxo-; Alpha-Ketosuberate
Molecular Structure CAS#: 96406-05-2, 2-Ketosuberate
Molecular Formula C8H12O5
Molecular Weight 188.18
CAS Registry Number 96406-05-2
SMILES C(C(C(=O)O)=O)CCCCC(=O)O
InChI 1S/C8H12O5/c9-6(8(12)13)4-2-1-3-5-7(10)11/h1-5H2,(H,10,11)(H,12,13)
InChIKey HAGOOZVJLSSXGZ-UHFFFAOYSA-N
Properties
Density 1.28g/cm3 (Cal.)
Boiling point 369.166°C at 760 mmHg (Cal.)
Flash point 191.247°C (Cal.)
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List of Reports Available for 2-Ketosuberate
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