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Structure

2-Cyanoacetylcoumarone

CAS
5149-69-9
Catalog Number
ACM5149699
Category
Other Products
Molecular Weight
185.17878
Molecular Formula
C11H7NO2

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Specification

Synonyms
2-Cyanoacetylcoumarone, 2-Benzo-furanacetonitrile, USAF KF-4, BENZOFURAN, 2-CYANOACETYL-, 2-Benzofuranpropionitrile, beta-oxo-, BRN 0146419, MolPort-002-466-562, 2-Benzofuranpropanenitrile, beta-oxo-, CID21232, ZINC02037392, BD-0229, LS-35048, 4-18-00-05598 (Beilstein Handbook Reference), 5149-69-9
IUPAC Name
3-(1-benzofuran-2-yl)-3-oxopropanenitrile
Canonical SMILES
C1=CC=C2C(=C1)C=C(O2)C(=O)CC#N
InChI Key
GCABLKFGYPIVFC-UHFFFAOYSA-N
Boiling Point
365.1ºC at 760mmHg
Melting Point
149-151ºC
Flash Point
174.6ºC
Density
1.253g/cm³
Exact Mass
185.04800
H-Bond Acceptor
3
H-Bond Donor
0
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