Home Halogens N-(4-methoxybenzyl)-2-chloro-3-nitropyridin-4-amine

N-(4-methoxybenzyl)-2-chloro-3-nitropyridin-4-amine

CAS No.:
881844-09-3
Catalog Number:
AG00GTZ6
Molecular Formula:
C13H12ClN3O3
Molecular Weight:
293.7057
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Product Description
Catalog Number:
AG00GTZ6
Chemical Name:
N-(4-methoxybenzyl)-2-chloro-3-nitropyridin-4-amine
CAS Number:
881844-09-3
Molecular Formula:
C13H12ClN3O3
Molecular Weight:
293.7057
MDL Number:
MFCD18207155
IUPAC Name:
2-chloro-N-[(4-methoxyphenyl)methyl]-3-nitropyridin-4-amine
InChI:
InChI=1S/C13H12ClN3O3/c1-20-10-4-2-9(3-5-10)8-16-11-6-7-15-13(14)12(11)17(18)19/h2-7H,8H2,1H3,(H,15,16)
InChI Key:
USGSNJLNFYSCNL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CNc1ccnc(c1[N+](=O)[O-])Cl
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.057g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.707g/mol
Monoisotopic Mass:
293.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties