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Chemical ID: 7508937
Chemical ID:
7508937
Name [?]:
1-(1-phenylethyl)piperidin-4-ol
SMILES [?]:
CC(c1ccccc1)N2CCC(CC2)O
InChi [?]:
InChI=1/C13H19NO/c1-11(12-5-3-2-4-6-12)14-9-7-13(15)8-10-14/h2-6,11,13,15H,7-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,6,5,7,4,8,11,13,10,14,2,3,12,9,15/E:(3,4)(5,6)(7,8)(9,10)/rA:15cCCCCCCCCNCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;s9;s10;s11;s12;s9s13;s12;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H19NO |
All Atoms: | 34 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.42339 |
Area: | 383.994 |
Solvation: | -2.17645 |
Coulombic: | -23.4197 |
Bond Count [?]
All: | 16 |
Single: | 13 |
Double: | 3 |
Rotors: | 2 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.13 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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Chemical Mix | Source | External ID | Descriptor | Value |
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