Uses
ChemicalBook > CAS DataBase List > 3-ACETYLBENZONITRILE

3-ACETYLBENZONITRILE

Uses
Product Name
3-ACETYLBENZONITRILE
CAS No.
6136-68-1
Chemical Name
3-ACETYLBENZONITRILE
Synonyms
3-CYANOACETOPHENONE;M-CYANOACETOPHENONE;3-ACETYLBENZONITRILE;M-ACETYLBENZONITRILE;3'-Cyanoacetophenone;3-acethylbenzonitrile;Benzonitrile, 3-acetyl-;3-Acetylbenzonitrile97%;1-Cyano-3-acetylbenzene;1-Acetyl-3-cyanobenzene
CBNumber
CB0424565
Molecular Formula
C9H7NO
Formula Weight
145.16
MOL File
6136-68-1.mol
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3-ACETYLBENZONITRILE Property

Melting point:
98-100 °C (lit.)
Boiling point:
120 °C (5 mmHg)
Density 
1.1555 (rough estimate)
refractive index 
1.4500 (estimate)
Flash point:
120°C/5mm
storage temp. 
Sealed in dry,Room Temperature
solubility 
4g/l
form 
Powder
color 
Pale yellow-orange to brown
Water Solubility 
Insoluble in water.
BRN 
2079629
InChI
InChI=1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3
InChIKey
SBCFGFDAZCTSRH-UHFFFAOYSA-N
SMILES
C(#N)C1=CC=CC(C(C)=O)=C1
CAS DataBase Reference
6136-68-1(CAS DataBase Reference)
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Safety

Hazard Codes 
Xn,Xi
Risk Statements 
20/21/22-36/37/38
Safety Statements 
26-37/39
RIDADR 
3439
WGK Germany 
3
Hazard Note 
Harmful/Irritant
TSCA 
T
HazardClass 
6.1
PackingGroup 
III
HS Code 
29269090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H301Toxic if swalloed

H302Harmful if swallowed

H312Harmful in contact with skin

H315Causes skin irritation

H319Causes serious eye irritation

H331Toxic if inhaled

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TCI Chemical
Product number
C1993
Product name
3'-Cyanoacetophenone
Purity
>98.0%(GC)
Packaging
5g
Price
$35
Updated
2024/03/01
TCI Chemical
Product number
C1993
Product name
3'-Cyanoacetophenone
Purity
>98.0%(GC)
Packaging
25g
Price
$116
Updated
2024/03/01
Alfa Aesar
Product number
A10841
Product name
3-Acetylbenzonitrile, 97+%
Packaging
5g
Price
$63.65
Updated
2024/03/01
Alfa Aesar
Product number
A10841
Product name
3-Acetylbenzonitrile, 97+%
Packaging
25g
Price
$223.65
Updated
2024/03/01
Alfa Aesar
Product number
A10841
Product name
3-Acetylbenzonitrile, 97+%
Packaging
100g
Price
$788
Updated
2021/12/16
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3-ACETYLBENZONITRILE Chemical Properties,Usage,Production

Uses

3-Acetylbenzonitrile has been used in the preparation of 3-(hydroxyacetyl)benzonitrile, and 3-(1-(3-(4-(pyridin-3-yl)pyrimidin-2-ylamino)-4-methylphenylimino)ethyl)benzonitrile.

Chemical Properties

Pale yellowish-orange to brown powder

Uses

Preparation of (q2-2-Acetyl-4-cyanophenyl)tetra- carbonylmanganese by Reaction of 3-Acetylbenzonitrile with Benzylpentacarbonylmanganese. Four aromatic amidoximes were synthesized by reacting hydroxylamine with 1,3 -dicyanobenzene, 1,4- dicyanobenzene, 3-acetylbenzonitrile, and 4-acetylbenzonitrile. Darzens condensation of 3-acetylbenzonitrile provided aldehyde.

Uses

3-Acetylbenzonitrile has been used in the preparation of:

  • 3-(hydroxyacetyl)benzonitrile
  • 3-(1-(3-(4-(pyridin-3-yl)pyrimidin-2-ylamino)-4-methylphenylimino)ethyl)benzonitrile

Definition

ChEBI: 3-Acetylbenzonitrile is an aromatic ketone.

Reactions

The reaction of 3-Acetylbenzonitrile and substituted benzaldehyde can be used for the synthesis of substituted 3-((E)-3-substituted phenylacryloyl)benzonitriles[1].

Synthesis Reference(s)

Tetrahedron Letters, 28, p. 2053, 1987 DOI: 10.1016/S0040-4039(00)96043-X

References

[1] D. KAMALAKKANNAN . Synthesis and assessment of substituent effect of some 3-((E)-3-substituted phenylacryloyl)benzonitriles[J]. Journal of Molecular Structure, 2022. DOI:10.1016/j.molstruc.2022.133218.

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3-ACETYLBENZONITRILE Suppliers

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View Lastest Price from 3-ACETYLBENZONITRILE manufacturers

Hebei Weibang Biotechnology Co., Ltd
Product
3-ACETYLBENZONITRILE 6136-68-1
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20 mt
Release date
2024-12-10
Nanjing Fred Technology Co., Ltd
Product
3-ACETYLBENZONITRILE 6136-68-1
Price
US $0.00-0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
1 ton
Release date
2023-12-20
Zhuozhou Wenxi import and Export Co., Ltd
Product
3-ACETYLBENZONITRILE 6136-68-1
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-08-11

6136-68-1, 3-ACETYLBENZONITRILERelated Search:


  • M-CYANOACETOPHENONE
  • M-ACETYLBENZONITRILE
  • Benzonitrile, 3-acetyl-
  • 3-CYANOACETOPHENONE
  • 3-ACETYLBENZONITRILE
  • 3-Acetylbenzonitrile97%
  • 3-acetylbenzonitrile,98%
  • 1-Acetyl-3-cyanobenzene
  • 1-Cyano-3-acetylbenzene
  • 3-Acetylbenzonitrile, 97% 5GR
  • 3-ACETYLBENZONITRILE FOR SYNTHESIS
  • 3'-cyanoacetophenone-3-Acetylbenzonitrile
  • 3-Acetylbenzonitrile 97%
  • 3-acethylbenzonitrile
  • 3'-Cyanoacetophenone &gt
  • U-Ring-13C6]-3'-Hydroxyacetophenone
  • 3'-Cyanoacetophenone
  • 6136-68-1
  • CH3COC6H4CN
  • Building Blocks
  • C8 to C9
  • Cyanides/Nitriles
  • Nitrogen Compounds
  • Organic Building Blocks
  • Aromatic Nitriles
  • Boron, Nitrile, Thio,& TM-Cpds
  • Carbonyl Compounds