Chemical ID: 4670952

CC(c1ccccc1)[NH3+]
Chemical ID:
4670952
Name [?]:
1-phenylethylammonium
SMILES [?]:
CC(c1ccccc1)[NH3+]
InChi [?]:
InChI=1/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/p+1
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,8,2,3,9/E:(3,4)(5,6)/rA:9cCCCCCCCCN+/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H12N+
All Atoms:9
Heavy Atoms:9
Chiral Atoms:1
ZAP Information [?]
Total:-31.1082
Area:282.161
Solvation:-38.1623
Coulombic:40.3952
Bond Count [?]
All:9
Single:6
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:122.188
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.67
LogP (Chemaxon):1.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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