1,1-Dimethylethyl 3-hydroxy-3,5-dimethyl-4-hexenoate
CAS Registry Number®
4161-61-9
CAS Name
1,1-Dimethylethyl 3-hydroxy-3,5-dimethyl-4-hexenoateMolecular Formula
C12H22O3Molecular Mass
214.30Cite this Page
1,1-Dimethylethyl 3-hydroxy-3,5-dimethyl-4-hexenoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=4161-61-9 (retrieved ) (CAS RN: 4161-61-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
70 °C @ Press: 1.5 TorrDensity (2)
0.929 g/cm³ @ Temp: 25 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C12H22O3/c1-9(2)7-12(6,14)8-10(13)15-11(3,4)5/h7,14H,8H2,1-6H3
InChIKey
InChIKey=QNVUXDUOFNRCCS-UHFFFAOYSA-N
SMILES
C(C(C=C(C)C)(C)O)C(OC(C)(C)C)=O
Canonical SMILES
O=C(OC(C)(C)C)CC(O)(C=C(C)C)C
Other Names for this Substance
- 4-Hexenoic acid, 3-hydroxy-3,5-dimethyl-, 1,1-dimethylethyl ester
- 4-Hexenoic acid, 3-hydroxy-3,5-dimethyl-, tert-butyl ester
- 1,1-Dimethylethyl 3-hydroxy-3,5-dimethyl-4-hexenoate
- 3-Hydroxy-3,5-dimethyl-hex-4-enoic acid tert-butyl ester
