Home Nitro Compounds 153775-42-9
153775-42-9,MFCD16876894
Catalog No.:AA00AQ40

153775-42-9 | 4-Cyano-3-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$7.00   $5.00
- +
1g
98%
in stock  
$12.00   $8.00
- +
25g
95%
in stock  
$183.00   $128.00
- +
100g
97%
in stock  
$668.00   $468.00
- +
  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00AQ40
Chemical Name:
4-Cyano-3-nitrobenzoic acid
CAS Number:
153775-42-9
Molecular Formula:
C8H4N2O4
Molecular Weight:
192.1284
MDL Number:
MFCD16876894
SMILES:
N#Cc1ccc(cc1[N+](=O)[O-])C(=O)O
Properties
Computed Properties
 
Complexity:
300  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.5  

Literature

Title: Direct generation of acyclic polypropionate stereopolyads via double diastereo- and enantioselective iridium-catalyzed crotylation of 1,3-diols: beyond stepwise carbonyl addition in polyketide construction.

Journal: Journal of the American Chemical Society 20110817

Title: Enhanced anti-diastereo- and enantioselectivity in alcohol-mediated carbonyl crotylation using an isolable single component iridium catalyst.

Journal: The Journal of organic chemistry 20110401

Title: Iridium-catalyzed anti-diastereo- and enantioselective carbonyl (trimethylsilyl)allylation from the alcohol or aldehyde oxidation level.

Journal: Journal of the American Chemical Society 20100707

Title: anti-Diastereo- and enantioselective carbonyl (hydroxymethyl)allylation from the alcohol or aldehyde oxidation level: allyl carbonates as allylmetal surrogates.

Journal: Journal of the American Chemical Society 20100407

Title: Diastereo- and enantioselective anti-alkoxyallylation employing allylic gem-dicarboxylates as allyl donors via iridium-catalyzed transfer hydrogenation.

Journal: Journal of the American Chemical Society 20100217

Title: anti-Diastereo- and enantioselective carbonyl crotylation from the alcohol or aldehyde oxidation level employing a cyclometallated iridium catalyst: alpha-methyl allyl acetate as a surrogate to preformed crotylmetal reagents.

Journal: Journal of the American Chemical Society 20090225

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Tags:153775-42-9 Molecular Formula|153775-42-9 MDL|153775-42-9 SMILES|153775-42-9 4-Cyano-3-nitrobenzoic acid