Chemical ID: 4264588

CC[N+](CC)(CC)CCCCC[N+](CC)(CC)CC
Chemical ID:
4264588
Name [?]:
triethyl-(5-triethylammoniopentyl)ammonium
SMILES [?]:
CC[N+](CC)(CC)CCCCC[N+](CC)(CC)CC
InChi [?]:
InChI=1/C17H40N2/c1-7-18(8-2,9-3)16-14-13-15-17-19(10-4,11-5)12-6/h7-17H2,1-6H3/q+2
InChi Info:
AuxInfo=1/0/N:1,5,7,15,17,19,2,4,6,14,16,18,10,9,11,8,12,3,13/E:(1,2,3,4,5,6)(7,8,9,10,11,12)(14,15)(16,17)(18,19)/CRV:18+1,19+1/rA:19nCCN+CCCCCCCCCN+CCCCCC/rB:s1;s2;s3;s4;s3;s6;s3;s8;s9;s10;s11;s12;s13;s14;s13;s16;s13;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H40N2+2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-60.9648
Area:514.898
Solvation:-73.8373
Coulombic:67.4343
Bond Count [?]
All:18
Single:18
Double:0
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:272.513
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.98
LogP (Chemaxon):-6.06

Name Annotations

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Descriptor Annotations

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