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Chemical ID: 7695750
Chemical ID:
7695750
Name [?]:
None
SMILES [?]:
CCCCCNc1ccc(cc1)C(=O)C
InChi [?]:
InChI=1/C13H19NO/c1-3-4-5-10-14-13-8-6-12(7-9-13)11(2)15/h6-9,14H,3-5,10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,15,2,3,4,9,11,8,12,5,13,10,7,6,14/E:(6,7)(8,9)/rA:15nCCCCCNCCCCCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s10;d13;s13;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H19NO |
All Atoms: | 34 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.65473 |
Area: | 426.637 |
Solvation: | -2.01119 |
Coulombic: | -20.6101 |
Bond Count [?]
All: | 15 |
Single: | 11 |
Double: | 4 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.43 |
LogP (Chemaxon): | None |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
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Experimental Annotations
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Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
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