Chemical ID: 5714274

CC1(CC(CCO1)(CC[NH3+])c2ccccc2)C
Chemical ID:
5714274
Name [?]:
2-(2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl)ethylammonium
SMILES [?]:
CC1(CC(CCO1)(CC[NH3+])c2ccccc2)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H24NO+
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:-31.128
Area:405.037
Solvation:-41.2539
Coulombic:33.0521
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:234.357
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.5
LogP (Chemaxon):2.11

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