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1260800-63-2 | Benzenecarboximidic acid, 2-fluoro-4-nitro-, ethyl ester
CAS No: 1260800-63-2 Catalog No: AG000RBN MDL No:
Product Description
Catalog Number:
AG000RBN
Chemical Name:
Benzenecarboximidic acid, 2-fluoro-4-nitro-, ethyl ester
CAS Number:
1260800-63-2
Molecular Formula:
C9H9FN2O3
Molecular Weight:
212.1778
IUPAC Name:
ethyl 2-fluoro-4-nitrobenzenecarboximidate
InChI:
InChI=1S/C9H9FN2O3/c1-2-15-9(11)7-4-3-6(12(13)14)5-8(7)10/h3-5,11H,2H2,1H3
InChI Key:
NDQNNENAKOVPIS-UHFFFAOYSA-N
SMILES:
CCOC(=N)c1ccc(cc1F)[N+](=O)[O-]
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.06g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.18g/mol
Monoisotopic Mass:
212.06g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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