Home Aminos N-(2-aminoethyl)-2-nitro-4-(trifluoromethyl)aniline hydrochloride

N-(2-aminoethyl)-2-nitro-4-(trifluoromethyl)aniline hydrochloride

CAS No.:
161605-61-4
Catalog Number:
AG00HYOM
Molecular Formula:
C9H11ClF3N3O2
Molecular Weight:
285.6507
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Product Description
Catalog Number:
AG00HYOM
Chemical Name:
N-(2-aminoethyl)-2-nitro-4-(trifluoromethyl)aniline hydrochloride
CAS Number:
161605-61-4
Molecular Formula:
C9H11ClF3N3O2
Molecular Weight:
285.6507
MDL Number:
MFCD01114784
IUPAC Name:
N'-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine;hydrochloride
InChI:
InChI=1S/C9H10F3N3O2.ClH/c10-9(11,12)6-1-2-7(14-4-3-13)8(5-6)15(16)17;/h1-2,5,14H,3-4,13H2;1H
InChI Key:
MIAKIEOHNSTAAB-UHFFFAOYSA-N
SMILES:
NCCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F.Cl
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.049g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
285.651g/mol
Monoisotopic Mass:
285.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties