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121832-04-0 | Ethanamine, N,N-difluoro-1,1-dinitro-
CAS No: 121832-04-0 Catalog No: AG001642 MDL No:
Product Description
Catalog Number:
AG001642
Chemical Name:
Ethanamine, N,N-difluoro-1,1-dinitro-
CAS Number:
121832-04-0
Molecular Formula:
C2H3F2N3O4
Molecular Weight:
171.0597
IUPAC Name:
N,N-difluoro-1,1-dinitroethanamine
InChI:
InChI=1S/C2H3F2N3O4/c1-2(5(3)4,6(8)9)7(10)11/h1H3
InChI Key:
JMNVMQZQNXASHF-UHFFFAOYSA-N
SMILES:
FN(C([N+](=O)[O-])([N+](=O)[O-])C)F
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.06g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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