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Benzoylacetonitrile, 98+%
CAS: 614-16-4 | C9H7NO | 145.16 g/mol
$90.03 - $1428.14
Chemical Identifiers
| CAS | 614-16-4 |
|---|---|
| Molecular Formula | C9H7NO |
| Molecular Weight (g/mol) | 145.16 |
| MDL Number | MFCD00001942 |
| InChI Key | ZJRCIQAMTAINCB-UHFFFAOYSA-N |
| Synonym | benzoylacetonitrile, 2-cyanoacetophenone, phenacyl cyanide, 3-oxo-3-phenyl-propionitrile, cyanomethyl phenyl ketone, acetonitrile, benzoyl, cyanoacetophenone, 3-phenyl-3-ketopropionitrile, benzenepropanenitrile, beta-oxo, benzoyl acetonitrile |
| PubChem CID | 64799 |
| ChEBI | CHEBI:51855 |
| IUPAC Name | 3-oxo-3-phenylpropanenitrile |
| SMILES | O=C(CC#N)C1=CC=CC=C1 |
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
|---|---|---|---|---|---|---|---|---|---|
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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AAA1447306
|
Thermo Scientific Chemicals
A1447306 |
5 g |
Each for $90.03
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AAA1447314
|
Thermo Scientific Chemicals
A1447314 |
25 g |
Each for $360.12
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AAA1447322
|
Thermo Scientific Chemicals
A1447322 |
100 g |
Each for $1,428.14
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Description
Benzoylacetonitrile is used to produce 2-benzoyl-3-furan-2-yl-acrylonitrile. It is also used in the synthesis of substituted naphtho[1,8-bc]pyrans and as building block in the preparation of 4H-pyrans, 2-pyridones, furans and carbocyclics. It is an active methylene compound, useful in heterocyclic synthesis, e.g. polyfunctional pyridines and pyrimidines.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
ApplicationsBenzoylacetonitrile is used to produce 2-benzoyl-3-furan-2-yl-acrylonitrile. It is also used in the synthesis of substituted naphtho[1,8-bc]pyrans and as building block in the preparation of 4H-pyrans, 2-pyridones, furans and carbocyclics. It is an active methylene compound, useful in heterocyclic synthesis, e.g. polyfunctional pyridines and pyrimidines.
Solubility
Slightly soluble in water.
Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
Chemical Identifiers
| 614-16-4 | |
| 145.16 | |
| ZJRCIQAMTAINCB-UHFFFAOYSA-N | |
| 64799 | |
| 3-oxo-3-phenylpropanenitrile |
| C9H7NO | |
| MFCD00001942 | |
| benzoylacetonitrile, 2-cyanoacetophenone, phenacyl cyanide, 3-oxo-3-phenyl-propionitrile, cyanomethyl phenyl ketone, acetonitrile, benzoyl, cyanoacetophenone, 3-phenyl-3-ketopropionitrile, benzenepropanenitrile, beta-oxo, benzoyl acetonitrile | |
| CHEBI:51855 | |
| O=C(CC#N)C1=CC=CC=C1 |
Specifications
| 614-16-4 | |
| 159°C to 160°C (10 mmHg) | |
| MFCD00001942 | |
| 386745 | |
| Slightly soluble in water. | |
| O=C(CC#N)C1=CC=CC=C1 | |
| 145.16 | |
| CHEBI:51855 | |
| ≥98% |
| 79°C to 83°C | |
| C9H7NO | |
| 5 g | |
| benzoylacetonitrile, 2-cyanoacetophenone, phenacyl cyanide, 3-oxo-3-phenyl-propionitrile, cyanomethyl phenyl ketone, acetonitrile, benzoyl, cyanoacetophenone, 3-phenyl-3-ketopropionitrile, benzenepropanenitrile, beta-oxo, benzoyl acetonitrile | |
| ZJRCIQAMTAINCB-UHFFFAOYSA-N | |
| 3-oxo-3-phenylpropanenitrile | |
| 64799 | |
| 145.16 | |
| Benzoylacetonitrile |
Safety and Handling
GHS H Statement
H301-H315-H319-H335
Toxic if swallowed.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
P261-P264b-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P362-P501c
H302+H312+H332-H315-H319-H335
EINECSNumber : 210-369-1
TSCA : Yes
Recommended Storage : Ambient temperatures
RUO – Research Use Only