Apiole
CAS Registry Number®
523-80-8
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CAS Name
ApioleMolecular Formula
C12H14O4Molecular Mass
222.24Cite this Page
Apiole. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=523-80-8 (retrieved ) (CAS RN: 523-80-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
294 °CMelting Point (1)
29.5 °CDensity (2)
1.176 g/cm³ @ Temp: 14 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Semenov, V. V.; Russian Chemical Bulletin, (2007), 56(12), 2448-2455, CAplus
Other Names and Identifiers
InChI
InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4,6H,1,5,7H2,2-3H3
InChIKey
InChIKey=QQRSPHJOOXUALR-UHFFFAOYSA-N
SMILES
O(C)C1=C2C(=C(OC)C=C1CC=C)OCO2
Canonical SMILES
O(C=1C=C(C(OC)=C2OCOC12)CC=C)C
Other Names for this Substance
- 1,3-Benzodioxole, 4,7-dimethoxy-5-(2-propen-1-yl)-
- Apiole
- Benzene, 1-allyl-2,5-dimethoxy-3,4-(methylenedioxy)-
- 1,3-Benzodioxole, 4,7-dimethoxy-5-(2-propenyl)-
- 4,7-Dimethoxy-5-(2-propen-1-yl)-1,3-benzodioxole
Deleted or Replaced CAS Registry Numbers
83382-66-5
