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Home Aldehydes 5-Hydroxy-2-nitrobenzaldehyde

5-Hydroxy-2-nitrobenzaldehyde

CAS No.:
42454-06-8
Catalog Number:
AG003MSF
Molecular Formula:
C7H5NO4
Molecular Weight:
167.1189
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$17
- +
25g
98%
In Stock USA
United States
$60
- +
100g
98%
In Stock USA
United States
$213
- +
Product Description
Catalog Number:
AG003MSF
Chemical Name:
5-Hydroxy-2-nitrobenzaldehyde
CAS Number:
42454-06-8
Molecular Formula:
C7H5NO4
Molecular Weight:
167.1189
MDL Number:
MFCD00007332
IUPAC Name:
5-hydroxy-2-nitrobenzaldehyde
InChI:
InChI=1S/C7H5NO4/c9-4-5-3-6(10)1-2-7(5)8(11)12/h1-4,10H
InChI Key:
XLYPHUGUKGMURE-UHFFFAOYSA-N
SMILES:
O=Cc1cc(O)ccc1[N+](=O)[O-]
EC Number:
255-832-9
UNII:
VA926Z93IF
NSC Number:
93899
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.022g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.12g/mol
Monoisotopic Mass:
167.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
2-Cyano-N'-(5-hy-droxy-2-nitro-benzyl-idene)acetohydrazide monohydrate. Acta crystallographica. Section E, Structure reports online 20110801
2-Chloro-N'-(5-hydr-oxy-2-nitro-benzyl-idene)benzohydrazide. Acta crystallographica. Section E, Structure reports online 20100201
(E)-4-Chloro-N'-(5-hydr-oxy-2-nitro-benzyl-idene)benzohydrazide. Acta crystallographica. Section E, Structure reports online 20091001
Solid-phase synthesis of tetrahydro-1,4-benzodiazepine-2-one derivatives as a beta-turn peptidomimetic library. Journal of combinatorial chemistry 20040101
Properties