3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone
CAS Registry Number®
58905-32-1
No image available.
CAS Name
3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanoneMolecular Formula
C8H13N3OMolecular Mass
167.21Cite this Page
3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58905-32-1 (retrieved ) (CAS RN: 58905-32-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
62-64 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C8H13N3O/c1-8(2,3)7(12)4-11-6-9-5-10-11/h5-6H,4H2,1-3H3
InChIKey
InChIKey=FMWWRALTYIWZEB-UHFFFAOYSA-N
SMILES
C(C(C)(C)C)(CN1C=NC=N1)=O
Canonical SMILES
O=C(CN1N=CN=C1)C(C)(C)C
Other Names for this Substance
- 2-Butanone, 3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-
- 3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone
- 3,3-Dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one
- 1,2,4-Triazol-1-ylpinacolin
- 1-(1,2,4-Triazol-1-yl)-3,3-dimethyl-2-butanone
Deleted or Replaced CAS Registry Numbers
103026-71-7
