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155199-99-8 | 1,3-Dithiolo[4,5-b][1,4,7]trithionin-2-one, 5,6,8,9-tetrahydro-
CAS No: 155199-99-8 Catalog No: AG001NPE MDL No:
Product Description
Catalog Number:
AG001NPE
Chemical Name:
1,3-Dithiolo[4,5-b][1,4,7]trithionin-2-one, 5,6,8,9-tetrahydro-
CAS Number:
155199-99-8
Molecular Formula:
C7H8OS5
Molecular Weight:
268.4628
IUPAC Name:
5,6,8,9-tetrahydro-[1,3]dithiolo[4,5-b][1,4,7]trithionin-2-one
InChI:
InChI=1S/C7H8OS5/c8-7-12-5-6(13-7)11-4-2-9-1-3-10-5/h1-4H2
InChI Key:
AHJYXFWWUIINNS-UHFFFAOYSA-N
SMILES:
O=c1sc2c(s1)SCCSCCS2
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.918g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.44g/mol
Monoisotopic Mass:
267.918g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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