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13190-21-1 | 2-Imidazolidinethione, 1,3-bis[(diethylamino)methyl]-
CAS No: 13190-21-1 Catalog No: AG000ZW8 MDL No:
Product Description
Catalog Number:
AG000ZW8
Chemical Name:
2-Imidazolidinethione, 1,3-bis[(diethylamino)methyl]-
CAS Number:
13190-21-1
Molecular Formula:
C13H28N4S
Molecular Weight:
272.4532
IUPAC Name:
1,3-bis(diethylaminomethyl)imidazolidine-2-thione
InChI:
InChI=1S/C13H28N4S/c1-5-14(6-2)11-16-9-10-17(13(16)18)12-15(7-3)8-4/h5-12H2,1-4H3
InChI Key:
ZVJRZYLEUIKWJI-UHFFFAOYSA-N
SMILES:
CCN(CN1CCN(C1=S)CN(CC)CC)CC
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.203g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.455g/mol
Monoisotopic Mass:
272.203g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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