Chemical ID: 7134520

CC(c1cc(ccc1OC)OC)[NH3+]
Chemical ID:
7134520
Name [?]:
1-(2,5-dimethoxyphenyl)ethylammonium
SMILES [?]:
CC(c1cc(ccc1OC)OC)[NH3+]
InChi [?]:
InChI=1/C10H15NO2/c1-7(11)9-6-8(12-2)4-5-10(9)13-3/h4-7H,11H2,1-3H3/p+1
InChi Info:
AuxInfo=1/1/N:1,12,10,6,7,4,2,5,3,8,13,11,9/rA:13cCCCCCCCCOCOCN+/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s5;s11;s2;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H16NO2+
All Atoms:29
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:-30.2319
Area:351.911
Solvation:-39.0297
Coulombic:26.9969
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:182.24
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.5
LogP (Chemaxon):1.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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