Chemical ID: 5611047

c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)O
Chemical ID:
5611047
Name [?]:
1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethanol
SMILES [?]:
c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)O
InChi [?]:
InChI=1/C11H10Cl2N2O/c12-8-1-2-9(10(13)5-8)11(16)6-15-4-3-14-7-15/h1-5,7,11,16H,6H2
InChi Info:
AuxInfo=1/0/N:1,2,13,12,5,10,15,6,3,4,9,7,8,14,11,16/rA:16cCCCCCCClClCCNCCNCO/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;s10;s11;d12;s13;s11d14;s9;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H10Cl2N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.52083
Area:424.187
Solvation:-3.08384
Coulombic:-28.1098
Bond Count [?]
All:17
Single:12
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:257.115
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.61
LogP (Chemaxon):2.44

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