Chemical ID: 4260869

CC(C(c1ccccc1)O)[NH3+]
Chemical ID:
4260869
Name [?]:
(2-hydroxy-1-methyl-2-phenyl-ethyl)ammonium
SMILES [?]:
CC(C(c1ccccc1)O)[NH3+]
InChi [?]:
InChI=1/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/p+1
InChi Info:
AuxInfo=1/1/N:1,7,6,8,5,9,2,4,3,11,10/E:(3,4)(5,6)/rA:11cCCCCCCCCCON+/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s3;s2;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H14NO+
All Atoms:11
Heavy Atoms:11
Chiral Atoms:2
ZAP Information [?]
Total:-31.9524
Area:314.888
Solvation:-39.8246
Coulombic:24.2683
Bond Count [?]
All:11
Single:8
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:152.214
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.0
LogP (Chemaxon):1.2

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