Chemical ID: 4957018

CCCCCCCCCC[n+]1ccccc1
Chemical ID:
4957018
Name [?]:
1-decylpyridine
SMILES [?]:
CCCCCCCCCC[n+]1ccccc1
InChi [?]:
InChI=1/C15H26N/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h9,11-12,14-15H,2-8,10,13H2,1H3/q+1
InChi Info:
AuxInfo=1/0/N:1,2,3,4,5,6,7,8,14,9,13,15,10,12,16,11/E:(11,12)(14,15)/CRV:16+1/rA:16nCCCCCCCCCCN+CCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H26N+
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-15.8932
Area:478.307
Solvation:-27.8509
Coulombic:17.5663
Bond Count [?]
All:16
Single:13
Double:3
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:220.374
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.34
LogP (Chemaxon):0.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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