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89582-54-7 | Urea,N-(4-methyl-1-piperazinyl)-
CAS No: 89582-54-7 Catalog No: AG003Z49 MDL No:
Product Description
Catalog Number:
AG003Z49
Chemical Name:
Urea,N-(4-methyl-1-piperazinyl)-
CAS Number:
89582-54-7
Molecular Formula:
C6H14N4O
Molecular Weight:
158.2016
IUPAC Name:
(4-methylpiperazin-1-yl)urea
InChI:
InChI=1S/C6H14N4O/c1-9-2-4-10(5-3-9)8-6(7)11/h2-5H2,1H3,(H3,7,8,11)
InChI Key:
VOUDNGYMQLJSJF-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)NC(=O)N
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.117g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.205g/mol
Monoisotopic Mass:
158.117g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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