tert-Butyl cyanoacetate
CAS Registry Number®
1116-98-9
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CAS Name
tert-Butyl cyanoacetateMolecular Formula
C7H11NO2Molecular Mass
141.17Cite this Page
tert-Butyl cyanoacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1116-98-9 (retrieved ) (CAS RN: 1116-98-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
90 °C @ Press: 10 TorrDensity (2)
1.0095 g/cm³ @ Temp: 21 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C7H11NO2/c1-7(2,3)10-6(9)4-5-8/h4H2,1-3H3
InChIKey
InChIKey=BFNYNEMRWHFIMR-UHFFFAOYSA-N
SMILES
C(OC(C)(C)C)(CC#N)=O
Canonical SMILES
N#CCC(=O)OC(C)(C)C
Other Names for this Substance
- Acetic acid, 2-cyano-, 1,1-dimethylethyl ester
- Acetic acid, cyano-, tert-butyl ester
- Acetic acid, cyano-, 1,1-dimethylethyl ester
- tert-Butyl cyanoacetate
- 1,1-Dimethylethyl cyanoacetate
Deleted or Replaced CAS Registry Numbers
57710-63-1, 1654002-83-1
