3-Oxo-2-propylheptanoic Acid Ethyl Ester - CAS 96610-56-9
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Catalog Number: R009968
CAS Number: 96610-56-9
PubChem Substance ID:355112647
Molecular Formula: C12H22O3
Molecular Weight:214.305
Purity: ≥95%
* For research use only. Not for human or veterinary use.
Synonym
Synonyms | Ethyl 3-Butyl-2-propyl-3-oxopropionate; ?β-Oxo-α-propylenanthic Acid Ethyl Ester? |
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Property
Molecular Formula: | C12H22O3 |
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Molecular Weight | 214.305 |
Purity | ≥95% |
Storage | -20°C |
Computed Descriptor
IUPAC Name | ethyl 3-oxo-2-propylheptanoate |
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InChI | InChI=1S/C12H22O3/c1-4-7-9-11(13)10(8-5-2)12(14)15-6-3/h10H,4-9H2,1-3H3 |
InChIKey | DUPHRBMRCNWSGR-UHFFFAOYSA-N |
SMILES | CCCCC(=O)C(CCC)C(=O)OCC |