Chemical ID: 6127995

Cc1cc(ccc1OCC(=O)Oc2ccc(cc2)Cl)Cl
Chemical ID:
6127995
Name [?]:
(4-chlorophenyl) 2-(4-chloro-2-methyl-phenoxy)acetate
SMILES [?]:
Cc1cc(ccc1OCC(=O)Oc2ccc(cc2)Cl)Cl
InChi [?]:
InChI=1/C15H12Cl2O3/c1-10-8-12(17)4-7-14(10)19-9-15(18)20-13-5-2-11(16)3-6-13/h2-8H,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,15,17,5,14,18,6,3,9,2,16,4,13,7,10,19,20,11,8,12/E:(2,3)(5,6)/rA:20nCCCCCCCOCCOOCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12Cl2O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.53534
Area:514.014
Solvation:-3.31501
Coulombic:-28.2808
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:311.159
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.41
LogP (Chemaxon):4.55

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