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2122-19-2 | 4-Methylimidazolidine-2-thione
CAS No: 2122-19-2 Catalog No: AG003LS2 MDL No:MFCD00121569
Product Description
Catalog Number:
AG003LS2
Chemical Name:
4-Methylimidazolidine-2-thione
CAS Number:
2122-19-2
Molecular Formula:
C4H8N2S
Molecular Weight:
116.1847
MDL Number:
MFCD00121569
IUPAC Name:
4-methylimidazolidine-2-thione
InChI:
InChI=1S/C4H8N2S/c1-3-2-5-4(7)6-3/h3H,2H2,1H3,(H2,5,6,7)
InChI Key:
NGZJXCFNBVJLQN-UHFFFAOYSA-N
SMILES:
CC1CNC(=S)N1
Properties
Complexity:
91.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.041g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
116.182g/mol
Monoisotopic Mass:
116.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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