Home Iodos 5398-69-6
5398-69-6,MFCD00277941
Catalog No.:AA003HDQ
5398-69-6 | 2-Iodo-3-nitrobenzoic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%(HPLC)
in stock  
$40.00
- +
1g
98%(HPLC)
in stock  
$77.00
- +
5g
>95%
in stock  
$188.00
- +
10g
98%(HPLC)
in stock  
$304.00
- +
25g
98%(HPLC)
in stock  
$638.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HDQ
Chemical Name:
2-Iodo-3-nitrobenzoic acid
CAS Number:
5398-69-6
Molecular Formula:
C7H4INO4
Molecular Weight:
293.0154
MDL Number:
MFCD00277941
IUPAC Name:
2-iodo-3-nitrobenzoic acid
InChI:
InChI=1S/C7H4INO4/c8-6-4(7(10)11)2-1-3-5(6)9(12)13/h1-3H,(H,10,11)
InChI Key:
XWOGTRRVKVPJSP-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1I)[N+](=O)[O-]
NSC Number:
4539
Properties
Computed Properties
 
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.919g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.016g/mol
Monoisotopic Mass:
292.919g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Synonyms
 
2-iodo-3-nitrobenzoic acid 
5398-69-6 
Benzoic acid,2-iodo-3-nitro- 
CTK4J9226 
KS-00000CSZ 
KS-00001PJW 
DTXSID50277861 
XWOGTRRVKVPJSP-UHFFFAOYSA-N 
ZINC163345 
2-Iodo-3-nitrobenzoic acid, 95% 
CS-B1198 
NSC-4539 
2-Iodo-3-nitro-benzoic acid 
7735AB 
ANW-71843 
MFCD00277941 
STL168506 
AKOS004114685 
AKOS015955198 
MCULE-4656147594 
TRA0094525 
AJ-16018 
AK-67608 
Benzoic acid, 2-iodo-3-nitro- 
DS-16685 
SC-04486 
SY019392 
TC-160588 
AM20080658 
FT-0687145 
ST24040709 
ST45087208 
Z-4537 
MFCD00277941 (95+%) 
2-Iodo-3-nitrobenzoicAcid 
C7H4INO4 
2-iodo-3-nitro-benzoicacid 
AR-1E2825 
CID220966 
ACN-050258 
6120-34-9 
NSC4539 
PubChem22605 
AC1Q5ATU 
SCHEMBL310876 
AC1L59L6 
Literature
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