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53517-95-6 | 3-allyl-5,5-dimethyl-2-thioxoimidazolidin-4-one
CAS No: 53517-95-6 Catalog No: AG00DMRI MDL No:
Product Description
Catalog Number:
AG00DMRI
Chemical Name:
3-allyl-5,5-dimethyl-2-thioxoimidazolidin-4-one
CAS Number:
53517-95-6
IUPAC Name:
5,5-dimethyl-3-prop-2-enyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C8H12N2OS/c1-4-5-10-6(11)8(2,3)9-7(10)12/h4H,1,5H2,2-3H3,(H,9,12)
InChI Key:
SHWHBFYMRFDNDU-UHFFFAOYSA-N
EC Number:
258-596-5
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.257g/mol
Monoisotopic Mass:
184.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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