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Home > Imidazoles > 852940-57-9
852940-57-9 | 1-(3-ethoxypropyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one
CAS No: 852940-57-9 Catalog No: AG019OB9 MDL No:MFCD06655834
Product Description
Catalog Number:
AG019OB9
Chemical Name:
1-(3-ethoxypropyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one
CAS Number:
852940-57-9
Molecular Formula:
C8H14N2O2S
Molecular Weight:
202.2740
MDL Number:
MFCD06655834
IUPAC Name:
3-(3-ethoxypropyl)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C8H14N2O2S/c1-2-12-5-3-4-10-7(11)6-9-8(10)13/h2-6H2,1H3,(H,9,13)
InChI Key:
PXWYBJMDYBFRRX-UHFFFAOYSA-N
SMILES:
CCOCCCN1C(=NCC1=O)S
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.078g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.272g/mol
Monoisotopic Mass:
202.078g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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