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263157-71-7 | Benzenecarboximidamide, 4-(4-chloro-3,5-dimethylphenoxy)-N-hydroxy-3-nitro-
CAS No: 263157-71-7 Catalog No: AG002SOD MDL No:
Product Description
Catalog Number:
AG002SOD
Chemical Name:
Benzenecarboximidamide, 4-(4-chloro-3,5-dimethylphenoxy)-N-hydroxy-3-nitro-
CAS Number:
263157-71-7
Molecular Formula:
C15H14ClN3O4
Molecular Weight:
335.7424
IUPAC Name:
4-(4-chloro-3,5-dimethylphenoxy)-N'-hydroxy-3-nitrobenzenecarboximidamide
InChI:
InChI=1S/C15H14ClN3O4/c1-8-5-11(6-9(2)14(8)16)23-13-4-3-10(15(17)18-20)7-12(13)19(21)22/h3-7,20H,1-2H3,(H2,17,18)
InChI Key:
YQVLDAOSZKKZFA-UHFFFAOYSA-N
SMILES:
ONC(=N)c1ccc(c(c1)[N+](=O)[O-])Oc1cc(C)c(c(c1)C)Cl
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.067g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
335.744g/mol
Monoisotopic Mass:
335.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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