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10242-12-3,MFCD00060513
Catalog No.:AA0007CM
10242-12-3 | 5-Nitrobenzofuran-2-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$50.00   $35.00
- +
5g
95%
in stock  
$194.00   $136.00
- +
25g
95%
in stock  
$762.00   $534.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0007CM
Chemical Name:
5-Nitrobenzofuran-2-carboxylic acid
CAS Number:
10242-12-3
Molecular Formula:
C9H5NO5
Molecular Weight:
207.1397
MDL Number:
MFCD00060513
IUPAC Name:
5-nitro-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C9H5NO5/c11-9(12)8-4-5-3-6(10(13)14)1-2-7(5)15-8/h1-4H,(H,11,12)
InChI Key:
LZKWLHXJPIKJSJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c(o1)ccc(c2)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.017g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.141g/mol
Monoisotopic Mass:
207.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
5-Nitrobenzofuran-2-carboxylic acid 
10242-12-3 
BAS 03293520 
AC1LRT9P 
buttpark 40\07-63 
nitrobenzofurancarboxylicacid 
AC1Q73UJ 
SCHEMBL654558 
SCHEMBL14036477 
CTK0I2807 
DTXSID90363111 
LZKWLHXJPIKJSJ-UHFFFAOYSA-N 
5-nitro-1-benzofuran-2-carboxylic acid 
SP340 
5-nitrocoumarone-2-carboxylic acid 
KS-000018WV 
ZINC1389517 
ANW-46387 
SBB017767 
STK195946 
AKOS000113255 
MCULE-7925519885 
RP12053 
2-Benzofurancarboxylic acid, 5-nitro- 
VZ30519 
5-nitrobenzofuran-2-carboxylic acid 97% 
AJ-25485 
SC-58331 
5-nitrobenzofuran-2-carboxylic acid ,98% 
5-Nitrobenzofuran-2-carboxylic acid, 97% 
ST2418837 
TR-000609 
FT-0636664 
ST50271321 
5-nitrobenzo[b]furan-2-carboxylic acid 
X8615 
EN300-41648 
4N-034 
J-517878 
I01-12553 
Z425485068 
C9H5NO5 
CID1477128 
2-carboxy-5-nitrobenzofuran 
5-nitro-2-benzofurancarboxylic acid 
2-Benzofurancarboxylicacid, 5-nitro- 
5-Nitro-benzofuran-2-carboxylic acid 
MFCD00060513 
Literature
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