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180570-35-8 | Acetonitrile, 2-(difluoroamino)-2,2-dinitro-
CAS No: 180570-35-8 Catalog No: AG00224F MDL No:
Product Description
Catalog Number:
AG00224F
Chemical Name:
Acetonitrile, 2-(difluoroamino)-2,2-dinitro-
CAS Number:
180570-35-8
Molecular Formula:
C2F2N4O4
Molecular Weight:
182.0426
IUPAC Name:
2-(difluoroamino)-2,2-dinitroacetonitrile
InChI:
InChI=1S/C2F2N4O4/c3-6(4)2(1-5,7(9)10)8(11)12
InChI Key:
AKDXEUNSZDIBOC-UHFFFAOYSA-N
SMILES:
FN(C([N+](=O)[O-])([N+](=O)[O-])C#N)F
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.989g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.043g/mol
Monoisotopic Mass:
181.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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