Chemical ID: 4663317

CCOC(=O)C(c1ccccc1)[NH+]2CCOCC2
Chemical ID:
4663317
Name [?]:
ethyl 2-(1-oxa-4-azoniacyclohex-4-yl)-2-phenyl-acetate
SMILES [?]:
CCOC(=O)C(c1ccccc1)[NH+]2CCOCC2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H20NO3+
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:-20.3381
Area:439.915
Solvation:-31.3359
Coulombic:4.61854
Bond Count [?]
All:19
Single:15
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:250.314
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.36
LogP (Chemaxon):1.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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