Chemical ID: 5030009

CCCCOC(=O)CN1C(=O)CCC1=O
Chemical ID:
5030009
Name [?]:
butyl 2-(2,5-dioxopyrrolidin-1-yl)acetate
SMILES [?]:
CCCCOC(=O)CN1C(=O)CCC1=O
InChi [?]:
InChI=1/C10H15NO4/c1-2-3-6-15-10(14)7-11-8(12)4-5-9(11)13/h2-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,12,13,4,8,10,14,6,9,11,15,7,5/E:(4,5)(8,9)(12,13)/rA:15nCCCCOCOCNCOCCCO/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;d10;s10;s12;s9s13;d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H15NO4
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.44676
Area:407.966
Solvation:-3.75239
Coulombic:-40.9498
Bond Count [?]
All:15
Single:12
Double:3
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:213.23
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:0.23
LogP (Chemaxon):-0.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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