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16586-60-0 | Methanone, [2-(4-nitrophenyl)diazenyl]phenyl-, 2-(2-benzothiazolyl)hydrazone
CAS No: 16586-60-0 Catalog No: AG001WE7 MDL No:
Product Description
Catalog Number:
AG001WE7
Chemical Name:
Methanone, [2-(4-nitrophenyl)diazenyl]phenyl-, 2-(2-benzothiazolyl)hydrazone
CAS Number:
16586-60-0
IUPAC Name:
4-chloro-3-nitrobenzamide
InChI:
InChI=1S/C7H5ClN2O3/c8-5-2-1-4(7(9)11)3-6(5)10(12)13/h1-3H,(H2,9,11)
InChI Key:
CGXRJCDXGJRBHV-UHFFFAOYSA-N
EC Number:
240-644-1
NSC Number:
127825
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.999g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.578g/mol
Monoisotopic Mass:
199.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| 4-Chloro-3-nitro-benzamide. | Acta crystallographica. Section E, Structure reports online 20090101 |
| 4-Chloro-3-nitro-benzonitrile. | Acta crystallographica. Section E, Structure reports online 20090101 |
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