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141186-70-1

141186-70-1 | 4H-Imidazol-4-one, 2,5-diamino-3,5-dihydro-

CAS No: 141186-70-1 Catalog No: AG001G1K MDL No:

Product Description

Catalog Number:
AG001G1K
Chemical Name:
4H-Imidazol-4-one, 2,5-diamino-3,5-dihydro-
CAS Number:
141186-70-1
Molecular Formula:
C3H6N4O
Molecular Weight:
114.1059
IUPAC Name:
2,4-diamino-1,4-dihydroimidazol-5-one
InChI:
InChI=1S/C3H6N4O/c4-1-2(8)7-3(5)6-1/h1H,4H2,(H3,5,6,7,8)
InChI Key:
UFGPLVQRCNMJFP-UHFFFAOYSA-N
SMILES:
O=C1NC(=NC1N)N

Properties

Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.054g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
114.108g/mol
Monoisotopic Mass:
114.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2  

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