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Chemical ID: 4957018
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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