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5715-02-6,MFCD00017360
Catalog No.:AA003G7W

5715-02-6 | 2-Acetoxybenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$28.00   $19.00
- +
5g
95%
in stock  
$59.00   $42.00
- +
25g
>97.0%(GC)
in stock  
$127.00   $89.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003G7W
Chemical Name:
2-Acetoxybenzonitrile
CAS Number:
5715-02-6
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00017360
SMILES:
N#Cc1ccccc1OC(=O)C
Properties
Properties
 
BP:
288.4°C at 760 mmHg  
Form:
Solid  
MP:
252-254 °C  
Refractive Index:
1.5150-1.5170  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
216  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Delabyetal.[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1956,vol.242,p.2644]

[2]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

[3]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

[4]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

[1]Miller[ChemischeBerichte,1889,vol.22,p.2794]Lach[ChemischeBerichte,1884,vol.17,p.1572]Beckmann[ChemischeBerichte,1893,vol.26,p.2625]

[1]Miller[ChemischeBerichte,1889,vol.22,p.2794]Lach[ChemischeBerichte,1884,vol.17,p.1572]Beckmann[ChemischeBerichte,1893,vol.26,p.2625]

[1]Atkinson;Heilbron[JournaloftheChemicalSociety,1926,p.2690]

[1]Atkinson;Heilbron[JournaloftheChemicalSociety,1926,p.2690]

Literature
Quotation Request
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SDS
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Tags:5715-02-6 Molecular Formula|5715-02-6 MDL|5715-02-6 SMILES|5715-02-6 2-Acetoxybenzonitrile
Catalog No.: AA003G7W
5715-02-6,MFCD00017360
5715-02-6 | 2-Acetoxybenzonitrile
Pack Size： 1g
Purity： 97%
in stock
$28.00 $19.00
Pack Size： 5g
Purity： 95%
in stock
$59.00 $42.00
Pack Size： 25g
Purity： >97.0%(GC)
in stock
$127.00 $89.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003G7W
Chemical Name: 2-Acetoxybenzonitrile
CAS Number: 5715-02-6
Molecular Formula: C9H7NO2
Molecular Weight: 161.1574
MDL Number: MFCD00017360
SMILES: N#Cc1ccccc1OC(=O)C
Properties
BP: 288.4°C at 760 mmHg  
Form: Solid  
MP: 252-254 °C  
Refractive Index: 1.5150-1.5170  
Storage: Keep in dry area;Room Temperature;  
Complexity: 216  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
Downstream Synthesis Route
5663-71-8    5715-02-6 

[1]Delabyetal.[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1956,vol.242,p.2644]

[2]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

[3]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

[4]Brownsort,PeterA.;Paton,Michael[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2339-2344]

21013-96-7    108-24-7    5715-02-6 

[1]Miller[ChemischeBerichte,1889,vol.22,p.2794]Lach[ChemischeBerichte,1884,vol.17,p.1572]Beckmann[ChemischeBerichte,1893,vol.26,p.2625]

21013-96-7    75-36-5    5715-02-6 

[1]Miller[ChemischeBerichte,1889,vol.22,p.2794]Lach[ChemischeBerichte,1884,vol.17,p.1572]Beckmann[ChemischeBerichte,1893,vol.26,p.2625]

5715-02-6    108-46-3    3722-51-8 

[1]Atkinson;Heilbron[JournaloftheChemicalSociety,1926,p.2690]

5715-02-6    108-46-3    3722-51-8    82-69-9 

[1]Atkinson;Heilbron[JournaloftheChemicalSociety,1926,p.2690]

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