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Home > Nitro Compounds > 132327-97-0
132327-97-0 | 2,1-Benzisothiazole-3-diazonium, 5-nitro-
CAS No: 132327-97-0 Catalog No: AG0010K5 MDL No:
Product Description
Catalog Number:
AG0010K5
Chemical Name:
2,1-Benzisothiazole-3-diazonium, 5-nitro-
CAS Number:
132327-97-0
Molecular Formula:
C7H3N4O2S+
Molecular Weight:
207.1893
IUPAC Name:
5-nitro-2,1-benzothiazole-3-diazonium
InChI:
InChI=1S/C7H3N4O2S/c8-9-7-5-3-4(11(12)13)1-2-6(5)10-14-7/h1-3H/q+1
InChI Key:
MVVIKFWGXXAETP-UHFFFAOYSA-N
SMILES:
N#[N+]c1snc2c1cc(cc2)[N+](=O)[O-]
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.998g/mol
Formal Charge:
1
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.187g/mol
Monoisotopic Mass:
206.998g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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