Home Nitros 1-N-[(4-Fluorophenyl)methyl]-3-nitrobenzene-1,4-diamine

1-N-[(4-Fluorophenyl)methyl]-3-nitrobenzene-1,4-diamine

CAS No.:
150812-21-8
Catalog Number:
AG001MVT
Molecular Formula:
C13H12FN3O2
Molecular Weight:
261.2517
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97.0%(T)(HPLC)
1 week
United States
$137
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Product Description
Catalog Number:
AG001MVT
Chemical Name:
1-N-[(4-Fluorophenyl)methyl]-3-nitrobenzene-1,4-diamine
CAS Number:
150812-21-8
Molecular Formula:
C13H12FN3O2
Molecular Weight:
261.2517
MDL Number:
MFCD12828054
IUPAC Name:
4-N-[(4-fluorophenyl)methyl]-2-nitrobenzene-1,4-diamine
InChI:
InChI=1S/C13H12FN3O2/c14-10-3-1-9(2-4-10)8-16-11-5-6-12(15)13(7-11)17(18)19/h1-7,16H,8,15H2
InChI Key:
XTDZJOIEYRRRGJ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CNc1ccc(c(c1)[N+](=O)[O-])N
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.091g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.256g/mol
Monoisotopic Mass:
261.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties