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1365272-38-3

1365272-38-3 | Benzenamine, 4-bromo-N-cyclohexyl-5-fluoro-2-nitro-

CAS No: 1365272-38-3 Catalog No: AG00120D MDL No:MFCD21609495

Product Description

Catalog Number:
AG00120D
Chemical Name:
Benzenamine, 4-bromo-N-cyclohexyl-5-fluoro-2-nitro-
CAS Number:
1365272-38-3
Molecular Formula:
C12H14BrFN2O2
Molecular Weight:
317.1542
MDL Number:
MFCD21609495
IUPAC Name:
4-bromo-N-cyclohexyl-5-fluoro-2-nitroaniline
InChI:
InChI=1S/C12H14BrFN2O2/c13-9-6-12(16(17)18)11(7-10(9)14)15-8-4-2-1-3-5-8/h6-8,15H,1-5H2
InChI Key:
YTSKGXPDJMHEHH-UHFFFAOYSA-N
SMILES:
Fc1cc(NC2CCCCC2)c(cc1Br)[N+](=O)[O-]

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.022g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
317.158g/mol
Monoisotopic Mass:
316.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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