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Chemical ID: 6487558
Chemical ID:
6487558
Name [?]:
4-amino-2,6-diphenyl-phenol
SMILES [?]:
c1ccc(cc1)c2cc(cc(c2O)c3ccccc3)N
InChi [?]:
InChI=1/C18H15NO/c19-15-11-16(13-7-3-1-4-8-13)18(20)17(12-15)14-9-5-2-6-10-14/h1-12,20H,19H2
InChi Info:
AuxInfo=1/0/N:1,17,2,6,16,18,3,5,15,19,8,10,4,14,9,7,11,12,20,13/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(16,17)/rA:20nCCCCCCCCCCCCOCCCCCCN/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s12;s11;s14;d15;s16;d17;d14s18;s9;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H15NO |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.2305 |
Area: | 453.913 |
Solvation: | -2.11733 |
Coulombic: | -36.3433 |
Bond Count [?]
All: | 22 |
Single: | 13 |
Double: | 9 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 261.318 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 2 |
XLogP: | 4.26 |
LogP (Chemaxon): | 4.35 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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