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137214-49-4 | 1,2-Ethanediamine, N1-ethyl-N2,N2-dimethyl-N1-(4-nitrophenyl)-
CAS No: 137214-49-4 Catalog No: AG0012YI MDL No:
Product Description
Catalog Number:
AG0012YI
Chemical Name:
1,2-Ethanediamine, N1-ethyl-N2,N2-dimethyl-N1-(4-nitrophenyl)-
CAS Number:
137214-49-4
Molecular Formula:
C12H19N3O2
Molecular Weight:
237.2982
IUPAC Name:
N'-ethyl-N,N-dimethyl-N'-(4-nitrophenyl)ethane-1,2-diamine
InChI:
InChI=1S/C12H19N3O2/c1-4-14(10-9-13(2)3)11-5-7-12(8-6-11)15(16)17/h5-8H,4,9-10H2,1-3H3
InChI Key:
HAIJNCRVAWFGPW-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)[N+](=O)[O-])CCN(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.148g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.303g/mol
Monoisotopic Mass:
237.148g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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