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89863-27-4 | 1,4,11,14-Tetrathiacycloeicosane-5,10,15,20-tetrone
CAS No: 89863-27-4 Catalog No: AG003X1J MDL No:
Product Description
Catalog Number:
AG003X1J
Chemical Name:
1,4,11,14-Tetrathiacycloeicosane-5,10,15,20-tetrone
CAS Number:
89863-27-4
Molecular Formula:
C16H24O4S4
Molecular Weight:
408.6194
IUPAC Name:
1,4,11,14-tetrathiacycloicosane-5,10,15,20-tetrone
InChI:
InChI=1S/C16H24O4S4/c17-13-5-1-2-6-14(18)22-11-12-24-16(20)8-4-3-7-15(19)23-10-9-21-13/h1-12H2
InChI Key:
XNNKIKAMNLNABU-UHFFFAOYSA-N
SMILES:
O=C1CCCCC(=O)SCCSC(=O)CCCCC(=O)SCCS1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.056g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
408.604g/mol
Monoisotopic Mass:
408.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
170A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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