α-Thujaplicin
CAS Registry Number®
1946-74-3
CAS Name
α-ThujaplicinMolecular Formula
C10H12O2Molecular Mass
164.20Cite this Page
α-Thujaplicin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1946-74-3 (retrieved ) (CAS RN: 1946-74-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
58-59 °C @ Press: 5 x 10-3 TorrMelting Point (2)
34 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(11)10(8)12/h3-7H,1-2H3,(H,11,12)
InChIKey
InChIKey=TUFYVOCKVJOUIR-UHFFFAOYSA-N
SMILES
C(C)(C)C1=C(O)C(=O)C=CC=C1
Canonical SMILES
O=C1C=CC=CC(=C1O)C(C)C
Other Names for this Substance
- 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-3-(1-methylethyl)-
- 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-3-isopropyl-
- 2-Hydroxy-3-(1-methylethyl)-2,4,6-cycloheptatrien-1-one
- α-Thujaplicin
- β-Isopropyltropolone
Deleted or Replaced CAS Registry Numbers
552-11-4