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10242-00-9,MFCD02664466
Catalog No.:AA0007C4
10242-00-9 | 6-Nitro-1h-indole-2-carboxylic acid
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250mg
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1g
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0007C4
Chemical Name:
6-Nitro-1h-indole-2-carboxylic acid
CAS Number:
10242-00-9
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
MDL Number:
MFCD02664466
IUPAC Name:
6-nitro-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C9H6N2O4/c12-9(13)8-3-5-1-2-6(11(14)15)4-7(5)10-8/h1-4,10H,(H,12,13)
InChI Key:
JIXJNWVLWQQNDB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)[nH]c(c2)C(=O)O
Properties
Computed Properties
 
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.157g/mol
Monoisotopic Mass:
206.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Synonyms
 
6-nitro-1H-indole-2-carboxylic Acid 
10242-00-9 
SCHEMBL396212 
CTK0H4472 
DTXSID70405806 
JIXJNWVLWQQNDB-UHFFFAOYSA-N 
BCP06219 
ICA-0149 
ZINC2582708 
ZX-BK000548 
7635AC 
BBL022369 
6-Nitroindole-2-carboxylic acid 
CN-086 
STK066419 
AKOS001476156 
1H-Indole-2-carboxylic acid, 6-nitro 
MCULE-6360877534 
SC-48094 
AB0108677 
DB-013797 
AM20020103 
FT-0660734 
1H-Indole-2-carboxylic acid, 6-nitro- 
H8125 
C9H6N2O4 
CID4714997 
6-nitroindol-2-carboxylic acid 
6-Nitro-2-indolecarboxylic acid 
MFCD02664466 
1H-Indole-2-carboxylicacid, 6-nitro- 
A1-00535 
AC1NFWG3 
Literature
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