Chemical ID: 7585116

CCOC(=O)C(CC[NH+]1CCOCC1)(c2ccccc2)c3ccccc3
Chemical ID:
7585116
Name [?]:
ethyl 4-(1-oxa-4-azoniacyclohex-4-yl)-2,2-diphenyl-butanoate
SMILES [?]:
CCOC(=O)C(CC[NH+]1CCOCC1)(c2ccccc2)c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H28NO3+
All Atoms:54
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:-19.8854
Area:565.419
Solvation:-34.0209
Coulombic:1.57645
Bond Count [?]
All:28
Single:21
Double:7
Rotors:8
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.96
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue