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189338-81-6 | 3H-1,2,4,7-Dithiadiazonine-3,8(9H)-dione, tetrahydro-4,7-dimethyl-
CAS No: 189338-81-6 Catalog No: AG002IC0 MDL No:
Product Description
Catalog Number:
AG002IC0
Chemical Name:
3H-1,2,4,7-Dithiadiazonine-3,8(9H)-dione, tetrahydro-4,7-dimethyl-
CAS Number:
189338-81-6
Molecular Formula:
C7H12N2O2S2
Molecular Weight:
220.3124
IUPAC Name:
4,7-dimethyl-1,2,4,7-dithiadiazonane-3,8-dione
InChI:
InChI=1S/C7H12N2O2S2/c1-8-3-4-9(2)7(11)13-12-5-6(8)10/h3-5H2,1-2H3
InChI Key:
FZVKQVKTYJXVIJ-UHFFFAOYSA-N
SMILES:
O=C1CSSC(=O)N(CCN1C)C
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.034g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.305g/mol
Monoisotopic Mass:
220.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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