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Chemical ID: 7698084
Chemical ID:
7698084
Name [?]:
None
SMILES [?]:
Cc1ccccc1OC(C)C(=O)NCCC(C)C
InChi [?]:
InChI=1/C15H23NO2/c1-11(2)9-10-16-15(17)13(4)18-14-8-6-5-7-12(14)3/h5-8,11,13H,9-10H2,1-4H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:17,18,1,10,4,5,3,6,15,14,16,2,9,7,11,13,12,8/E:(1,2)/rA:18cCCCCCCCOCCCONCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s9;d11;s11;s13;s14;s15;s16;s16;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H23NO2 |
All Atoms: | 41 |
Heavy Atoms: | 18 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.59846 |
Area: | 475.595 |
Solvation: | -3.2914 |
Coulombic: | -30.6997 |
Bond Count [?]
All: | 18 |
Single: | 14 |
Double: | 4 |
Rotors: | 7 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.72 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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