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Home Aldehydes 2,4-Dinitrobenzaldehyde

2,4-Dinitrobenzaldehyde

CAS No.:
528-75-6
Catalog Number:
AG003FUX
Molecular Formula:
C7H4N2O5
Molecular Weight:
196.1171
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$25
- +
25g
97%
In Stock USA
United States
$62
- +
100g
97%
In Stock USA
United States
$157
- +
Product Description
Catalog Number:
AG003FUX
Chemical Name:
2,4-Dinitrobenzaldehyde
CAS Number:
528-75-6
Molecular Formula:
C7H4N2O5
Molecular Weight:
196.1171
MDL Number:
MFCD00013376
IUPAC Name:
2,4-dinitrobenzaldehyde
InChI:
InChI=1S/C7H4N2O5/c10-4-5-1-2-6(8(11)12)3-7(5)9(13)14/h1-4H
InChI Key:
ZILXIZUBLXVYPI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1N(=O)=O)N(=O)=O
EC Number:
208-440-7
UNII:
ZAC919YU3Z
NSC Number:
36948
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.012g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.118g/mol
Monoisotopic Mass:
196.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
1-[2-(2,4-Dinitro-benzyl-ideneamino)phen-yl]-3-phenyl-thio-urea. Acta crystallographica. Section E, Structure reports online 20091001
Accurate determinations of the extent to which the SE2' reactions of allyl-, allenyl- and propargylsilanes are stereospecifically anti. Organic & biomolecular chemistry 20040307
Reaction of vinylcarbenoids with benzaldehydes: formation of vinylcarbonyl ylides followed by ring closure to oxiranes and dihydrofurans. The Journal of organic chemistry 20010810
Properties