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613-90-1,MFCD00001837
Catalog No.:AA003O07

613-90-1 | Benzoyl cyanide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$6.00   $4.00
- +
25g
98%
in stock  
$7.00   $5.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003O07
Chemical Name:
Benzoyl cyanide
CAS Number:
613-90-1
Molecular Formula:
C8H5NO
Molecular Weight:
131.1314
MDL Number:
MFCD00001837
SMILES:
N#CC(=O)c1ccccc1
Properties
Properties
 
BP:
206°C at 760 mmHg  
Form:
Solid  
MP:
28-31 °C(lit.);  
Refractive Index:
1.4700 (estimate)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
171  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Literature

Title: Biosynthesis of benzoylformic acid from benzoyl cyanide by a newly isolated Rhodococcus sp. CCZU10-1 in toluene-water biphasic system.

Journal: Bioresource technology 20120701

Title: Probing Retroviral and Retrotransposon Genome Structures: The 'SHAPE' of Things to Come.

Journal: Molecular biology international 20120101

Title: RNA folding and catalysis mediated by iron (II).

Journal: PloS one 20120101

Title: A powerful approach for the selection of 2-aminopurine substitution sites to investigate RNA folding.

Journal: Journal of the American Chemical Society 20111012

Title: Release of hydrogen cyanide via a post-secretion Schotten-Baumann reaction in defensive fluids of polydesmoid millipedes.

Journal: Journal of chemical ecology 20110301

Title: Nickel/Lewis acid-catalyzed cyanoesterification and cyanocarbamoylation of alkynes.

Journal: Journal of the American Chemical Society 20100728

Title: N-(1,3-Thia-zol-2-yl)benzamide.

Journal: Acta crystallographica. Section E, Structure reports online 20090401

Title: Time-resolved RNA SHAPE chemistry: quantitative RNA structure analysis in one-second snapshots and at single-nucleotide resolution.

Journal: Nature protocols 20090101

Title: Time-resolved RNA SHAPE chemistry.

Journal: Journal of the American Chemical Society 20081203

Title: 'Green' methodology for efficient and selective benzoylation of nucleosides using benzoyl cyanide in an ionic liquid.

Journal: Bioorganic & medicinal chemistry 20050715

Title: Mild, efficient, selective and 'green' benzoylation of nucleosides using benzoyl cyanide in ionic liquid.

Journal: Nucleosides, nucleotides & nucleic acids 20050101

Title: Cyanobenzoylation and hydrocyanation of aldehydes with benzoyl cyanide using no catalyst.

Journal: Organic letters 20030724

Title: De novo synthesis of a methylene-bridged Neu5Ac-alpha-(2,3)-gal C-disaccharide.

Journal: The Journal of organic chemistry 20010615

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Tags:613-90-1 Molecular Formula|613-90-1 MDL|613-90-1 SMILES|613-90-1 Benzoyl cyanide
Catalog No.: AA003O07
613-90-1,MFCD00001837
613-90-1 | Benzoyl cyanide
Pack Size： 5g
Purity： 98%
in stock
$6.00 $4.00
Pack Size： 25g
Purity： 98%
in stock
$7.00 $5.00
Quantity
- +
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Technical Information
Catalog Number: AA003O07
Chemical Name: Benzoyl cyanide
CAS Number: 613-90-1
Molecular Formula: C8H5NO
Molecular Weight: 131.1314
MDL Number: MFCD00001837
SMILES: N#CC(=O)c1ccccc1
Properties
BP: 206°C at 760 mmHg  
Form: Solid  
MP: 28-31 °C(lit.);  
Refractive Index: 1.4700 (estimate)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 171  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
Literature fold

Title: Biosynthesis of benzoylformic acid from benzoyl cyanide by a newly isolated Rhodococcus sp. CCZU10-1 in toluene-water biphasic system.

Journal: Bioresource technology20120701

Title: Probing Retroviral and Retrotransposon Genome Structures: The 'SHAPE' of Things to Come.

Journal: Molecular biology international20120101

Title: RNA folding and catalysis mediated by iron (II).

Journal: PloS one20120101

Title: A powerful approach for the selection of 2-aminopurine substitution sites to investigate RNA folding.

Journal: Journal of the American Chemical Society20111012

Title: Release of hydrogen cyanide via a post-secretion Schotten-Baumann reaction in defensive fluids of polydesmoid millipedes.

Journal: Journal of chemical ecology20110301

Title: Nickel/Lewis acid-catalyzed cyanoesterification and cyanocarbamoylation of alkynes.

Journal: Journal of the American Chemical Society20100728

Title: N-(1,3-Thia-zol-2-yl)benzamide.

Journal: Acta crystallographica. Section E, Structure reports online20090401

Title: Time-resolved RNA SHAPE chemistry: quantitative RNA structure analysis in one-second snapshots and at single-nucleotide resolution.

Journal: Nature protocols20090101

Title: Time-resolved RNA SHAPE chemistry.

Journal: Journal of the American Chemical Society20081203

Title: 'Green' methodology for efficient and selective benzoylation of nucleosides using benzoyl cyanide in an ionic liquid.

Journal: Bioorganic & medicinal chemistry20050715

Title: Mild, efficient, selective and 'green' benzoylation of nucleosides using benzoyl cyanide in ionic liquid.

Journal: Nucleosides, nucleotides & nucleic acids20050101

Title: Cyanobenzoylation and hydrocyanation of aldehydes with benzoyl cyanide using no catalyst.

Journal: Organic letters20030724

Title: De novo synthesis of a methylene-bridged Neu5Ac-alpha-(2,3)-gal C-disaccharide.

Journal: The Journal of organic chemistry20010615

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