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16439-79-5

16439-79-5 | Urea, N-(4,6-diamino-1,3,5-triazin-2-yl)-

CAS No: 16439-79-5 Catalog No: AG001UV2 MDL No:MFCD30492335

Product Description

Catalog Number:
AG001UV2
Chemical Name:
Urea, N-(4,6-diamino-1,3,5-triazin-2-yl)-
CAS Number:
16439-79-5
Molecular Formula:
C4H7N7O
Molecular Weight:
169.1447
MDL Number:
MFCD30492335
IUPAC Name:
(4,6-diamino-1,3,5-triazin-2-yl)urea
InChI:
InChI=1S/C4H7N7O/c5-1-8-2(6)10-4(9-1)11-3(7)12/h(H7,5,6,7,8,9,10,11,12)
InChI Key:
UROVNNMQBJLRGG-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1nc(N)nc(n1)N

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.071g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
169.148g/mol
Monoisotopic Mass:
169.071g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  

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