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Chemical ID: 5205075
Chemical ID:
5205075
Name [?]:
acridin-9-ylmethanol
SMILES [?]:
c1ccc2c(c1)c(c3ccccc3n2)CO
InChi [?]:
InChI=1/C14H11NO/c16-9-12-10-5-1-3-7-13(10)15-14-8-4-2-6-11(12)14/h1-8,16H,9H2
InChi Info:
AuxInfo=1/0/N:1,10,2,11,6,9,3,12,15,5,8,7,4,13,14,16/E:(1,2)(3,4)(5,6)(7,8)(10,11)(13,14)/rA:16nCCCCCCCCCCCCCNCO/rB:s1;d2;s3;s4;d1s5;d5;s7;s8;d9;s10;d11;d8s12;d4s13;s7;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H11NO |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.65807 |
Area: | 370.468 |
Solvation: | -2.60363 |
Coulombic: | -24.0019 |
Bond Count [?]
All: | 18 |
Single: | 11 |
Double: | 7 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 209.243 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 2.67 |
LogP (Chemaxon): | 3.0 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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