Home Iodos 5458-84-4
5458-84-4,MFCD00040509
Catalog No.:AA003HDT
5458-84-4 | 1-Iodo-2-methoxy-4-nitrobenzene
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5g
98%
in stock  
$8.00
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25g
98%
in stock  
$18.00
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100g
97%
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$70.00
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  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA003HDT
Chemical Name:
1-Iodo-2-methoxy-4-nitrobenzene
CAS Number:
5458-84-4
Molecular Formula:
C7H6INO3
Molecular Weight:
279.0319
MDL Number:
MFCD00040509
IUPAC Name:
1-iodo-2-methoxy-4-nitrobenzene
InChI:
InChI=1S/C7H6INO3/c1-12-7-4-5(9(10)11)2-3-6(7)8/h2-4H,1H3
InChI Key:
RBFWMPRFYROKPI-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1I)[N+](=O)[O-]
NSC Number:
24644
Properties
Computed Properties
 
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.939g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.033g/mol
Monoisotopic Mass:
278.939g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
2-Iodo-5-nitroanisole 
5458-84-4 
6-iodo-3-nitroanisol 
ACMC-209lhl 
AC1L5ISA 
AC1Q4PJC 
AC1Q45LX 
AC1Q45LY 
SCHEMBL446056 
CTK5A1820 
KS-00000LJV 
DTXSID50282132 
1-iodo-2-methoxy-4-nitrobenzene 
RBFWMPRFYROKPI-UHFFFAOYSA-N 
ACT11692 
STR08281 
ZINC1614563 
ANW-32119 
BBL009514 
MFCD00024590 
NSC-24644 
SBB064459 
STL119792 
4-Iodo-3-methoxynitrobenzene 
AKOS005232628 
AC-3813 
AM62026 
AS01818 
AS04176 
CM11784 
LS10410 
MCULE-6877136171 
TRA0082668 
VZ24794 
1-iodo-2-methoxy-4-nitro-benzene 
AJ-28271 
AK-79109 
AN-12583 
CJ-26062 
SC-46113 
AB0031252 
DB-021230 
ST2415351 
TR-032891 
FT-0635733 
Benzene, 1-iodo-2-methoxy-4-nitro- 
X4267 
EN300-39970 
TL800742061 
A19873 
C-4644 
I01-4893 
4-Iodo-3-methoxynitrobenzene;1-Iodo-2-methoxy-4-nitrobenzene 
C7H6INO3 
AR-1C4089 
CID230103 
Benzene,1-iodo-2-methoxy-4-nitro- 
ACN-050495 
2-Iodo-5-nitroanisole, 95% - 100G 100g 
6318-20-3 
ATTERCOP-CHM AT115587 
NSC24644 
PubChem2668 
Literature
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