ChemDB: Chemical Search
Download
Chemical ID: 5151203
Chemical ID:
5151203
Name [?]:
9-azabicyclo[6.2.0]dec-4-en-10-one
SMILES [?]:
C1CC2C(CCC=C1)NC2=O
InChi [?]:
InChI=1/C9H13NO/c11-9-7-5-3-1-2-4-6-8(7)10-9/h1-2,7-8H,3-6H2,(H,10,11)
InChi Info:
AuxInfo=1/1/N:8,7,1,6,2,5,3,4,10,9,11/rA:11cCCCCCCCCNCO/rB:s1;s2;s3;s4;s5;s6;s1w7;s4;s3s9;d10;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H13NO |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 5.84427 |
Area: | 296.295 |
Solvation: | -1.5631 |
Coulombic: | -21.973 |
Bond Count [?]
All: | 12 |
Single: | 10 |
Double: | 2 |
Rotors: | 0 |
Chiral: | 0 |
Rigid Segments: | 1 |
Chemical Properties
Molecular Weight: | 151.206 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 1.29 |
LogP (Chemaxon): | 0.97 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|