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Home Aldehydes 6-Nitroveratraldehyde

6-Nitroveratraldehyde

CAS No.:
20357-25-9
Catalog Number:
AG0028ZN
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$13
- +
5g
96%
In Stock USA
United States
$32
- +
25g
96%
In Stock USA
United States
$88
- +
100g
96%
In Stock USA
United States
$300
- +
500g
96%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG0028ZN
Chemical Name:
6-Nitroveratraldehyde
CAS Number:
20357-25-9
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD00007134
IUPAC Name:
4,5-dimethoxy-2-nitrobenzaldehyde
InChI:
InChI=1S/C9H9NO5/c1-14-8-3-6(5-11)7(10(12)13)4-9(8)15-2/h3-5H,1-2H3
InChI Key:
YWSPWKXREVSQCA-UHFFFAOYSA-N
SMILES:
COc1cc([N+](=O)[O-])c(cc1OC)C=O
EC Number:
243-762-1
NSC Number:
65590
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.173g/mol
Monoisotopic Mass:
211.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Modulation of DNA repair by pharmacological inhibitors of the PIKK protein kinase family. Bioorganic & medicinal chemistry letters 20120901
High susceptibility of metastatic cells derived from human prostate and colon cancer cells to TRAIL and sensitization of TRAIL-insensitive primary cells to TRAIL by 4,5-dimethoxy-2-nitrobenzaldehyde. Molecular cancer 20110101
(2E)-1-(3-Bromo-phen-yl)-3-(4,5-dimeth-oxy-2-nitro-phen-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20101101
Properties