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89417-98-1

89417-98-1 | 2-(acetylamino)propanediamide

CAS No: 89417-98-1 Catalog No: AG004634 MDL No:

Product Description

Catalog Number:
AG004634
Chemical Name:
2-(acetylamino)propanediamide
CAS Number:
89417-98-1
Molecular Formula:
C5H9N3O3
Molecular Weight:
159.1433
IUPAC Name:
2-acetamidopropanediamide
InChI:
InChI=1S/C5H9N3O3/c1-2(9)8-3(4(6)10)5(7)11/h3H,1H3,(H2,6,10)(H2,7,11)(H,8,9)
InChI Key:
WAMPZZSZWZCGGS-UHFFFAOYSA-N
SMILES:
CC(=O)NC(C(=O)N)C(=O)N
NSC Number:
75207

Properties

Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
159.145g/mol
Monoisotopic Mass:
159.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.4  

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