Home Aldehydes 1021493-53-7
1021493-53-7,MFCD19441865
Catalog No.:AA0006O2
1021493-53-7 | 3-Methoxy-4-iodo-5-nitro-benzaldehyde
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$358.00   $250.00
- +
5g
98%
in stock  
$1,191.00   $834.00
- +
10g
98%
in stock  
$2,055.00   $1,439.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0006O2
Chemical Name:
3-Methoxy-4-iodo-5-nitro-benzaldehyde
CAS Number:
1021493-53-7
Molecular Formula:
C8H6INO4
Molecular Weight:
307.0420
MDL Number:
MFCD19441865
IUPAC Name:
4-iodo-3-methoxy-5-nitrobenzaldehyde
InChI:
InChI=1S/C8H6INO4/c1-14-7-3-5(4-11)2-6(8(7)9)10(12)13/h2-4H,1H3
InChI Key:
WVDDJASTMZNUNH-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)c(c(c1)[N+](=O)[O-])I
Properties
Computed Properties
 
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.934g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.043g/mol
Monoisotopic Mass:
306.934g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
4-Iodo-3-methoxy-5-nitrobenzaldehyde 
1021493-53-7 
Benzaldehyde, 4-iodo-3-methoxy-5-nitro- 
AB0097561 
AJ-118856 
AX8258974 
Z-8905 
3-Methoxy-4-iodo-5-nitro-benzaldehyde 
CTK4A0739 
DTXSID50721132 
ZINC71864049 
3-Methoxy-4-iodo-5-nitrobenzaldehyde 
AKOS015995154 
FCH1358907 
QC-8811 
Literature
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