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299920-42-6 | 3-[2-(1,1-Dioxido-1,2-benzisothiazol-3-yl)-hydrazino]propanenitrile
CAS No: 299920-42-6 Catalog No: AG00I5KY MDL No:
Product Description
Catalog Number:
AG00I5KY
Chemical Name:
3-[2-(1,1-Dioxido-1,2-benzisothiazol-3-yl)-hydrazino]propanenitrile
CAS Number:
299920-42-6
IUPAC Name:
3-[2-(1,1-dioxo-1,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
InChI:
InChI=1S/C10H10N4O2S/c11-6-3-7-12-13-10-8-4-1-2-5-9(8)17(15,16)14-10/h1-2,4-5,12H,3,7H2,(H,13,14)
InChI Key:
GKFWPXOGAOERPJ-UHFFFAOYSA-N
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.052g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.276g/mol
Monoisotopic Mass:
250.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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