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208252-67-9 | Urea, N-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-
CAS No: 208252-67-9 Catalog No: AG002JLJ MDL No:
Product Description
Catalog Number:
AG002JLJ
Chemical Name:
Urea, N-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-
CAS Number:
208252-67-9
Molecular Formula:
C6H9N5O2
Molecular Weight:
183.1680
IUPAC Name:
(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
InChI:
InChI=1S/C6H9N5O2/c1-3-8-5(10-4(7)12)11-6(9-3)13-2/h1-2H3,(H3,7,8,9,10,11,12)
InChI Key:
NEVDMPLXCGERDI-UHFFFAOYSA-N
SMILES:
COc1nc(NC(=O)N)nc(n1)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.171g/mol
Monoisotopic Mass:
183.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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