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Chemical ID: 6510325
Chemical ID:
6510325
Name [?]:
4-(1-cyclohex-3-enyl)pyridine
SMILES [?]:
c1cnccc1C2CCC=CC2
InChi [?]:
InChI=1/C11H13N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-2,6-10H,3-5H2
InChi Info:
AuxInfo=1/0/N:10,11,9,12,8,1,5,2,4,7,6,3/E:(6,7)(8,9)/rA:12cCCNCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;d10;s7s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H13N |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.91801 |
Area: | 326.535 |
Solvation: | -1.24538 |
Coulombic: | -6.534 |
Bond Count [?]
All: | 13 |
Single: | 9 |
Double: | 4 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 159.228 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 3.03 |
LogP (Chemaxon): | 2.35 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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