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88753-52-0 | Pyridine, 3,3'-azoxybis[6-(butylthio)-
CAS No: 88753-52-0 Catalog No: AG004CO3 MDL No:
Product Description
Catalog Number:
AG004CO3
Chemical Name:
Pyridine, 3,3'-azoxybis[6-(butylthio)-
CAS Number:
88753-52-0
Molecular Formula:
C18H24N4OS2
Molecular Weight:
376.5394
IUPAC Name:
(6-butylsulfanylpyridin-3-yl)-(6-butylsulfanylpyridin-3-yl)imino-oxidoazanium
InChI:
InChI=1S/C18H24N4OS2/c1-3-5-11-24-17-9-7-15(13-19-17)21-22(23)16-8-10-18(20-14-16)25-12-6-4-2/h7-10,13-14H,3-6,11-12H2,1-2H3
InChI Key:
HQFVSSOAZGGEAL-UHFFFAOYSA-N
SMILES:
CCCCSc1ccc(cn1)N=[N+](c1ccc(nc1)SCCCC)[O-]
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.139g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.537g/mol
Monoisotopic Mass:
376.139g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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