Chemical ID: 7005026

CCC1C=CCC2C1C(=O)N(C2=O)CCCC(=O)O
Chemical ID:
7005026
Name [?]:
4-(4-ethyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)butanoic acid
SMILES [?]:
CCC1C=CCC2C1C(=O)N(C2=O)CCCC(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H19NO4
All Atoms:38
Heavy Atoms:19
Chiral Atoms:3
ZAP Information [?]
Total:7.81058
Area:458.096
Solvation:-3.64183
Coulombic:-50.1665
Bond Count [?]
All:20
Single:16
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:265.305
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.01
LogP (Chemaxon):1.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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