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34293-22-6

34293-22-6 | 2-imino-1,3-dimethylimidazolidin-4-one

CAS No: 34293-22-6 Catalog No: AG00CN7N MDL No:MFCD01243272

Product Description

Catalog Number:
AG00CN7N
Chemical Name:
2-imino-1,3-dimethylimidazolidin-4-one
CAS Number:
34293-22-6
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD01243272
IUPAC Name:
2-imino-1,3-dimethylimidazolidin-4-one
InChI:
InChI=1S/C5H9N3O/c1-7-3-4(9)8(2)5(7)6/h6H,3H2,1-2H3
InChI Key:
NQLHETVWDMRIPV-UHFFFAOYSA-N
SMILES:
CN1CC(=O)N(C1=N)C

Properties

Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.075g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.147g/mol
Monoisotopic Mass:
127.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  

Literature

Title Journal
Aplysinopsins--marine indole alkaloids: chemistry, bioactivity and ecological significance. Marine drugs 20090601

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