Home Fluorides 110729-51-6
110729-51-6,MFCD15527248
Catalog No.:AA003H99
110729-51-6 | 2-Fluoro-N-methyl-5-nitroaniline
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$80.00
- +
5g
95%
in stock  
$245.00
- +
10g
95%
in stock  
$328.00
- +
25g
95%
in stock  
$645.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003H99
Chemical Name:
2-Fluoro-N-methyl-5-nitroaniline
CAS Number:
110729-51-6
Molecular Formula:
C7H7FN2O2
Molecular Weight:
170.1411
MDL Number:
MFCD15527248
IUPAC Name:
2-fluoro-N-methyl-5-nitroaniline
InChI:
InChI=1S/C7H7FN2O2/c1-9-7-4-5(10(11)12)2-3-6(7)8/h2-4,9H,1H3
InChI Key:
YWKHWTYJUYVMND-UHFFFAOYSA-N
SMILES:
CNc1cc(ccc1F)[N+](=O)[O-]
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:
170.049g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.143g/mol
Monoisotopic Mass:
170.049g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
2-Fluoro-N-methyl-5-nitroaniline 
110729-51-6 
CS-11757 
SY029473 
FT-0726260 
MFCD15527248 (97%) 
2-fluoro-N-methyl-5-nitroBenzenamine 
Benzenamine, 2-fluoro-N-methyl-5-nitro- 
SCHEMBL7703266 
N-Methyl-2-fluoro-5-nitroaniline 
MFCD15527248 
ZINC34193718 
AKOS012389593 
TRA0096467 
KS-000009Z1 
Literature
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