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Chemical ID: 5066545
Chemical ID:
5066545
Name [?]:
2-[2-(2-furyl)vinyl]pyridine
SMILES [?]:
c1ccnc(c1)C=Cc2ccco2
InChi [?]:
InChI=1/C11H9NO/c1-2-8-12-10(4-1)6-7-11-5-3-9-13-11/h1-9H
InChi Info:
AuxInfo=1/0/N:1,2,11,6,10,7,8,3,12,5,9,4,13/rA:13nCCCNCCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;d9;s10;d11;s9s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H9NO |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.47167 |
Area: | 329.783 |
Solvation: | -2.7729 |
Coulombic: | -11.0047 |
Bond Count [?]
All: | 14 |
Single: | 8 |
Double: | 6 |
Rotors: | 2 |
Chiral: | 1 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 171.195 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 1.77 |
LogP (Chemaxon): | 2.17 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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