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40408-55-7 | 1-(1,1-dioxo-1lambda6-thiolan-3-yl)imidazolidine-2,4,5-trione
CAS No: 40408-55-7 Catalog No: AG019L06 MDL No:MFCD11205060
Product Description
Catalog Number:
AG019L06
Chemical Name:
1-(1,1-dioxo-1lambda6-thiolan-3-yl)imidazolidine-2,4,5-trione
CAS Number:
40408-55-7
Molecular Formula:
C7H8N2O5S
Molecular Weight:
232.2138
MDL Number:
MFCD11205060
IUPAC Name:
1-(1,1-dioxothiolan-3-yl)imidazolidine-2,4,5-trione
InChI:
InChI=1S/C7H8N2O5S/c10-5-6(11)9(7(12)8-5)4-1-2-15(13,14)3-4/h4H,1-3H2,(H,8,10,12)
InChI Key:
YKMXWWNVVFTAQV-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(=O)N1C1CCS(=O)(=O)C1
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.015g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.21g/mol
Monoisotopic Mass:
232.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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