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Chemical ID: 6661985
Chemical ID:
6661985
Name [?]:
2-(p-tolylaminomethyl)phenol
SMILES [?]:
Cc1ccc(cc1)NCc2ccccc2O
InChi [?]:
InChI=1/C14H15NO/c1-11-6-8-13(9-7-11)15-10-12-4-2-3-5-14(12)16/h2-9,15-16H,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,13,11,14,3,7,4,6,9,2,10,5,15,8,16/E:(6,7)(8,9)/rA:16nCCCCCCCNCCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H15NO |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.19 |
Area: | 408.964 |
Solvation: | -2.03409 |
Coulombic: | -30.0415 |
Bond Count [?]
All: | 17 |
Single: | 11 |
Double: | 6 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 213.275 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 3.41 |
LogP (Chemaxon): | 3.58 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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