Chemical ID: 6917904

c1cc(ccc1C(CCl)c2ccc(cc2)Cl)Cl
Chemical ID:
6917904
Name [?]:
1-chloro-4-[2-chloro-1-(4-chlorophenyl)-ethyl]-benzene
SMILES [?]:
c1cc(ccc1C(CCl)c2ccc(cc2)Cl)Cl
InChi [?]:
InChI=1/C14H11Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-8,14H,9H2
InChi Info:
AuxInfo=1/0/N:1,5,11,15,2,4,12,14,8,6,10,3,13,7,9,17,16/E:(1,2,3,4)(5,6,7,8)(10,11)(12,13)(16,17)/rA:17nCCCCCCCCClCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s7;s10;d11;s12;d13;d10s14;s13;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11Cl3
All Atoms:28
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:10.3311
Area:465.358
Solvation:-1.30286
Coulombic:-4.67563
Bond Count [?]
All:18
Single:12
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:285.595
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.58
LogP (Chemaxon):5.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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