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236102-72-0,MFCD00834942
Catalog No.:AA003HP7
236102-72-0 | 2'-Nitrobiphenyl-3-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$172.00   $120.00
- +
5g
97%
in stock  
$572.00   $400.00
- +
10g
97%
in stock  
$953.00   $667.00
- +
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Technical Information
Catalog Number:
AA003HP7
Chemical Name:
2'-Nitrobiphenyl-3-carboxylic acid
CAS Number:
236102-72-0
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
MDL Number:
MFCD00834942
IUPAC Name:
3-(2-nitrophenyl)benzoic acid
InChI:
InChI=1S/C13H9NO4/c15-13(16)10-5-3-4-9(8-10)11-6-1-2-7-12(11)14(17)18/h1-8H,(H,15,16)
InChI Key:
MIVOQZYLGZRQHP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1c1cccc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.053g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.218g/mol
Monoisotopic Mass:
243.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
236102-72-0 
2'-Nitro-[1,1'-biphenyl]-3-carboxylic acid 
ZINC33427599 
AKOS015833475 
AJ-86096 
2-Nitro-[1,1-biphenyl]-3-carboxylic acid 
AX8243086 
TR-010948 
2'-Nitro[1,1'-biphenyl]-3-carboxylic acid 
[1,1'-Biphenyl]-3-carboxylicacid, 2'-nitro- 
3- benzoicacid 
C13H9NO4 
2'-NITROBIPHENYL-3-CARBOXYLIC ACID 
2-Nitrobiphenyl-3-carboxylic acid 
2'-Nitro-[1,1'-biphenyl]-3-carboxylicacid 
3-(2-Nitrophenyl)benzoic acid 
ACMC-20aij4 
CTK1A0329 
DTXSID30680718 
1609AB 
ANW-74942 
MFCD00834942 
Literature
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