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Chemical ID: 7696510
Chemical ID:
7696510
Name [?]:
None
SMILES [?]:
c1ccc(cc1)CC(=O)Nc2cc(ccc2O)Cl
InChi [?]:
InChI=1/C14H12ClNO2/c15-11-6-7-13(17)12(9-11)16-14(18)8-10-4-2-1-3-5-10/h1-7,9,17H,8H2,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,14,15,7,12,4,13,11,16,8,18,10,17,9/E:(2,3)(4,5)/rA:18nCCCCCCCCONCCCCCCOCl/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s16;s13;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H12ClNO2 |
All Atoms: | 30 |
Heavy Atoms: | 18 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.3709 |
Area: | 448.379 |
Solvation: | -2.83857 |
Coulombic: | -38.0638 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 7 |
Rotors: | 4 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.45 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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