Chemical ID: 6680413

CC(=O)CC(=O)N(C)C
Chemical ID:
6680413
Name [?]:
N,N-dimethyl-3-oxo-butanamide
SMILES [?]:
CC(=O)CC(=O)N(C)C
InChi [?]:
InChI=1/C6H11NO2/c1-5(8)4-6(9)7(2)3/h4H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,8,9,4,2,5,7,3,6/E:(2,3)/rA:9nCCOCCONCC/rB:s1;d2;s2;s4;d5;s5;s7;s7;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H11NO2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:2.91736
Area:289.178
Solvation:-4.3121
Coulombic:-18.665
Bond Count [?]
All:8
Single:6
Double:2
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:129.157
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:-0.1
LogP (Chemaxon):-0.13

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue