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Chemical ID: 6665748
Chemical ID:
6665748
Name [?]:
N-(2-chlorophenyl)-1-(2,4-dichlorophenyl)-methanimine
SMILES [?]:
c1ccc(c(c1)N=Cc2ccc(cc2Cl)Cl)Cl
InChi [?]:
InChI=1/C13H8Cl3N/c14-10-6-5-9(12(16)7-10)8-17-13-4-2-1-3-11(13)15/h1-8H
InChi Info:
AuxInfo=1/0/N:2,1,3,6,10,11,13,8,9,12,4,14,5,16,17,15,7/rA:17nCCCCCCNCCCCCCCClClCl/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;s9;d10;s11;d12;d9s13;s14;s12;s4;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H8Cl3N |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.34979 |
Area: | 421.918 |
Solvation: | -1.19816 |
Coulombic: | -8.9761 |
Bond Count [?]
All: | 18 |
Single: | 11 |
Double: | 7 |
Rotors: | 2 |
Chiral: | 1 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 284.567 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 5.24 |
LogP (Chemaxon): | 5.8 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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