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Chemical ID: 7690438
Chemical ID:
7690438
Name [?]:
None
SMILES [?]:
Cc1cc(cc(c1Cl)C)OCC(=NO)N
InChi [?]:
InChI=1/C10H13ClN2O2/c1-6-3-8(4-7(2)10(6)11)15-5-9(12)13-14/h3-4,14H,5H2,1-2H3,(H2,12,13)
InChi Info:
AuxInfo=1/1/N:1,9,3,5,11,2,6,4,12,7,8,15,13,14,10/E:(1,2)(3,4)(6,7)/rA:15nCCCCCCCClCOCCNON/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s4;s10;s11;w12;s13;s12;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H13ClN2O2 |
All Atoms: | 28 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 6.62234 |
Area: | 399.748 |
Solvation: | -3.37135 |
Coulombic: | -36.5167 |
Bond Count [?]
All: | 15 |
Single: | 11 |
Double: | 4 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.22 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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