1-Ethoxy-4-isothiocyanatobenzene
CAS Registry Number®
3460-49-9
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CAS Name
1-Ethoxy-4-isothiocyanatobenzeneMolecular Formula
C9H9NOSMolecular Mass
179.24Cite this Page
1-Ethoxy-4-isothiocyanatobenzene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3460-49-9 (retrieved ) (CAS RN: 3460-49-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
153-154 °C @ Press: 15 TorrMelting Point (2)
62 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C9H9NOS/c1-2-11-9-5-3-8(4-6-9)10-7-12/h3-6H,2H2,1H3
InChIKey
InChIKey=REEKOMRZYJXXNR-UHFFFAOYSA-N
SMILES
N(=C=S)C1=CC=C(OCC)C=C1
Canonical SMILES
S=C=NC1=CC=C(OCC)C=C1
Other Names for this Substance
- Benzene, 1-ethoxy-4-isothiocyanato-
- Isothiocyanic acid, p-ethoxyphenyl ester
- Phenetole, p-isothiocyanato-
- 1-Ethoxy-4-isothiocyanatobenzene
- p-Ethoxyphenyl isothiocyanate
