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19958-73-7 | Thiourea, N,N-diethyl-N'-(4-methyl-2-thiazolyl)-
CAS No: 19958-73-7 Catalog No: AG002C77 MDL No:
Product Description
Catalog Number:
AG002C77
Chemical Name:
Thiourea, N,N-diethyl-N'-(4-methyl-2-thiazolyl)-
CAS Number:
19958-73-7
Molecular Formula:
C9H15N3S2
Molecular Weight:
229.3655
IUPAC Name:
1,1-diethyl-3-(4-methyl-1,3-thiazol-2-yl)thiourea
InChI:
InChI=1S/C9H15N3S2/c1-4-12(5-2)9(13)11-8-10-7(3)6-14-8/h6H,4-5H2,1-3H3,(H,10,11,13)
InChI Key:
MGTWKELPVOVVKW-UHFFFAOYSA-N
SMILES:
CCN(C(=S)Nc1scc(n1)C)CC
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.071g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.36g/mol
Monoisotopic Mass:
229.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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