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Chemical ID: 7232264
Chemical ID:
7232264
Name [?]:
5-acetyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
SMILES [?]:
CC(=O)N1CC2CC1C(=O)O2
InChi [?]:
InChI=1/C7H9NO3/c1-4(9)8-3-5-2-6(8)7(10)11-5/h5-6H,2-3H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,5,2,6,8,9,4,3,10,11/rA:11cCCONCCCCCOO/rB:s1;d2;s2;s4;s5;s6;s4s7;s8;d9;s6s9;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H9NO3 |
All Atoms: | 20 |
Heavy Atoms: | 11 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 3.60665 |
Area: | 299.591 |
Solvation: | -3.88312 |
Coulombic: | -32.0307 |
Bond Count [?]
All: | 12 |
Single: | 10 |
Double: | 2 |
Rotors: | 1 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | -0.37 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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