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Home > Nitro Compounds > 80945-68-2
80945-68-2 | 2(3H)-Benzothiazolone,4-nitro-,hydrazone(9CI)
CAS No: 80945-68-2 Catalog No: AG00G43L MDL No:
Product Description
Catalog Number:
AG00G43L
Chemical Name:
2(3H)-Benzothiazolone,4-nitro-,hydrazone(9CI)
CAS Number:
80945-68-2
IUPAC Name:
(4-nitro-1,3-benzothiazol-2-yl)hydrazine
InChI:
InChI=1S/C7H6N4O2S/c8-10-7-9-6-4(11(12)13)2-1-3-5(6)14-7/h1-3H,8H2,(H,9,10)
InChI Key:
AVDOFMGETZDDRR-UHFFFAOYSA-N
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.021g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.211g/mol
Monoisotopic Mass:
210.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Pharmacological evaluation and characterizations of newly synthesized 1,2,4-triazoles. | European journal of medicinal chemistry 20100901 |
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