Ioxynil octanoate
CAS Registry Number®
3861-47-0
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CAS Name
Ioxynil octanoateMolecular Formula
C15H17I2NO2Molecular Mass
497.11Cite this Page
Ioxynil octanoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3861-47-0 (retrieved ) (CAS RN: 3861-47-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
59.5 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C15H17I2NO2/c1-2-3-4-5-6-7-14(19)20-15-12(16)8-11(10-18)9-13(15)17/h8-9H,2-7H2,1H3
InChIKey
InChIKey=QBEXFUOWUYCXNI-UHFFFAOYSA-N
SMILES
O(C(CCCCCCC)=O)C1=C(I)C=C(C#N)C=C1I
Canonical SMILES
N#CC1=CC(I)=C(OC(=O)CCCCCCC)C(I)=C1
Other Names for this Substance
- Octanoic acid, 4-cyano-2,6-diiodophenyl ester
- Octanoic acid, ester with 4-hydroxy-3,5-diiodobenzonitrile
- Ioxynil octanoate
- 3,5-Diiodo-4-n-octanoyloxybenzonitrile
- MB 11641
Deleted or Replaced CAS Registry Numbers
33964-25-9
