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DIACETAMIDE

CAS No.:
625-77-4
Catalog Number:
AG0034P6
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
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Product Description
Catalog Number:
AG0034P6
Chemical Name:
DIACETAMIDE
CAS Number:
625-77-4
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
MDL Number:
MFCD00008679
IUPAC Name:
N-acetylacetamide
InChI:
InChI=1S/C4H7NO2/c1-3(6)5-4(2)7/h1-2H3,(H,5,6,7)
InChI Key:
ZSBDPRIWBYHIAF-UHFFFAOYSA-N
SMILES:
CC(=O)NC(=O)C
EC Number:
210-910-1
NSC Number:
405639
Properties
Complexity:
85.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.048g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
101.105g/mol
Monoisotopic Mass:
101.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  
Literature
Title Journal
N-Acetyl-N-[2,4-dicyano-1-(4-meth-oxy-phen-yl)-9,10-dihydro-phenanthren-3-yl]acetamide. Acta crystallographica. Section E, Structure reports online 20120401
A steroid isolated from the water mold Achlya heterosexualis induces neurogenesis in vitro and in vivo. Steroids 20120201
Conductivity and viscosity behavior of asymmetric phosphonium iodides. The journal of physical chemistry. B 20100401
Hydroacridines: part 29. 15N NMR chemical shifts of 9-substituted 1,2,3,4,5,6,7,8-octahydroacridines and their N-oxides-Taft, Swain-Lupton, and other types of linear correlations. Magnetic resonance in chemistry : MRC 20081201
Ab initio studies of solvent effect on molecular conformation and vibrational spectra of diacetamide. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040401
(1E)-2-(Diacetylamino)-1-methylprop-1-enyl acetate. Acta crystallographica. Section C, Crystal structure communications 20040301
Glycosylation of N-acetylglucosamine: imidate formation and unexpected conformation. Organic letters 20030724
Properties