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2138069-13-1 | 3a-methyl-hexahydro-1lambda6-imidazolidino[1,5-b][1,2]thiazole-1,1,6-trione
CAS No: 2138069-13-1 Catalog No: AG01EIN5 MDL No:MFCD31559074
Product Description
Catalog Number:
AG01EIN5
Chemical Name:
3a-methyl-hexahydro-1lambda6-imidazolidino[1,5-b][1,2]thiazole-1,1,6-trione
CAS Number:
2138069-13-1
Molecular Formula:
C6H10N2O3S
Molecular Weight:
190.2202
MDL Number:
MFCD31559074
IUPAC Name:
3a-methyl-1,1-dioxo-2,3,4,5-tetrahydroimidazo[1,5-b][1,2]thiazol-6-one
InChI:
InChI=1S/C6H10N2O3S/c1-6-2-3-12(10,11)8(6)5(9)7-4-6/h2-4H2,1H3,(H,7,9)
InChI Key:
JHWZSGVFXWAKLU-UHFFFAOYSA-N
SMILES:
O=C1NCC2(N1S(=O)(=O)CC2)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.217g/mol
Monoisotopic Mass:
190.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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