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Home > Fluorides > 1214373-48-4
1214373-48-4 | Benzamide, 2-nitro-4-(trifluoromethoxy)-
CAS No: 1214373-48-4 Catalog No: AG0014XH MDL No:
Product Description
Catalog Number:
AG0014XH
Chemical Name:
Benzamide, 2-nitro-4-(trifluoromethoxy)-
CAS Number:
1214373-48-4
Molecular Formula:
C8H5F3N2O4
Molecular Weight:
250.1315
IUPAC Name:
2-nitro-4-(trifluoromethoxy)benzamide
InChI:
InChI=1S/C8H5F3N2O4/c9-8(10,11)17-4-1-2-5(7(12)14)6(3-4)13(15)16/h1-3H,(H2,12,14)
InChI Key:
FYNZURGLQYBZGO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1C(=O)N)OC(F)(F)F
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.02g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.133g/mol
Monoisotopic Mass:
250.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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