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10242-21-4 | Benzene, 2,4-dinitro-1-(2,2,2-trifluoroethoxy)-
CAS No: 10242-21-4 Catalog No: AG0007FA MDL No:
Product Description
Catalog Number:
AG0007FA
Chemical Name:
Benzene, 2,4-dinitro-1-(2,2,2-trifluoroethoxy)-
CAS Number:
10242-21-4
Molecular Formula:
C8H5F3N2O5
Molecular Weight:
266.1309
IUPAC Name:
2,4-dinitro-1-(2,2,2-trifluoroethoxy)benzene
InChI:
InChI=1S/C8H5F3N2O5/c9-8(10,11)4-18-7-2-1-5(12(14)15)3-6(7)13(16)17/h1-3H,4H2
InChI Key:
RCEGERQWXLNNCW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1OCC(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.015g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.132g/mol
Monoisotopic Mass:
266.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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