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Chemical ID: 7101660
Chemical ID:
7101660
Name [?]:
2-[2-chloro-6-methoxy-4-(methylaminomethyl)phenoxy]acetamide
SMILES [?]:
CNCc1cc(c(c(c1)Cl)OCC(=O)N)OC
InChi [?]:
InChI=1/C11H15ClN2O3/c1-14-5-7-3-8(12)11(9(4-7)16-2)17-6-10(13)15/h3-4,14H,5-6H2,1-2H3,(H2,13,15)
InChi Info:
AuxInfo=1/1/N:1,17,9,5,3,12,4,8,6,13,7,10,15,2,14,16,11/rA:17nCNCCCCCCCClOCCONOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s7;s11;s12;d13;s13;s6;s16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H15ClN2O3 |
All Atoms: | 32 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.57807 |
Area: | 450.566 |
Solvation: | -5.68608 |
Coulombic: | -48.3466 |
Bond Count [?]
All: | 17 |
Single: | 13 |
Double: | 4 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 258.701 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 5 |
XLogP: | 0.37 |
LogP (Chemaxon): | 0.26 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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