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855929-29-2

855929-29-2 | N-Acetyl 3,5-dibromo-2-nitroaniline

CAS No: 855929-29-2 Catalog No: AG003SOD MDL No:MFCD09972088

Product Description

Catalog Number:
AG003SOD
Chemical Name:
N-Acetyl 3,5-dibromo-2-nitroaniline
CAS Number:
855929-29-2
Molecular Formula:
C8H6Br2N2O3
Molecular Weight:
337.9528
MDL Number:
MFCD09972088
IUPAC Name:
N-(3,5-dibromo-2-nitrophenyl)acetamide
InChI:
InChI=1S/C8H6Br2N2O3/c1-4(13)11-7-3-5(9)2-6(10)8(7)12(14)15/h2-3H,1H3,(H,11,13)
InChI Key:
GEEGGWMAUYBKBT-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(Br)cc(c1[N+](=O)[O-])Br

Properties

Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.872g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
337.955g/mol
Monoisotopic Mass:
335.875g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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