Chemical ID: 4116361

C1COCC[NH2+]1
Chemical ID:
4116361
Name [?]:
1-oxa-4-azoniacyclohexane
SMILES [?]:
C1COCC[NH2+]1
InChi [?]:
InChI=1/C4H9NO/c1-3-6-4-2-5-1/h5H,1-4H2/p+1
InChi Info:
AuxInfo=1/1/N:1,5,2,4,6,3/E:(1,2)(3,4)/rA:6nCCOCCN+/rB:s1;s2;s3;s4;s1s5;/rC:;;;;;;

Chemical Details

Atom Count
Formula:C4H10NO+
All Atoms:6
Heavy Atoms:6
Chiral Atoms:0
ZAP Information [?]
Total:-32.1667
Area:218.959
Solvation:-37.6407
Coulombic:30.566
Bond Count [?]
All:6
Single:6
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:88.1283
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:-0.58
LogP (Chemaxon):-0.55

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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