Butanoic acid, 2-acetyl-3-methyl-, ethyl ester
CAS Registry Number®
1522-46-9
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CAS Name
Butanoic acid, 2-acetyl-3-methyl-, ethyl esterMolecular Formula
C9H16O3Molecular Mass
172.22Cite this Page
Butanoic acid, 2-acetyl-3-methyl-, ethyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1522-46-9 (retrieved ) (CAS RN: 1522-46-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
201 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C9H16O3/c1-5-12-9(11)8(6(2)3)7(4)10/h6,8H,5H2,1-4H3
InChIKey
InChIKey=DMIFFKCVURTPTG-UHFFFAOYSA-N
SMILES
C(C(OCC)=O)(C(C)C)C(C)=O
Canonical SMILES
O=C(OCC)C(C(=O)C)C(C)C
Other Names for this Substance
- Butanoic acid, 2-acetyl-3-methyl-, ethyl ester
- Acetoacetic acid, 2-isopropyl-, ethyl ester
- Isovaleric acid, α-acetyl-, Et ester
- Ethyl α-isopropylacetoacetate
- Ethyl 2-isopropylacetoacetate
Deleted or Replaced CAS Registry Numbers
152548-74-8
