Chemical ID: 7088606

c1cc(ccc1C(c2ccc(c(c2)Cl)Cl)O)F
Chemical ID:
7088606
Name [?]:
(3,4-dichlorophenyl)-(4-fluorophenyl)-methanol
SMILES [?]:
c1cc(ccc1C(c2ccc(c(c2)Cl)Cl)O)F
InChi [?]:
InChI=1/C13H9Cl2FO/c14-11-6-3-9(7-12(11)15)13(17)8-1-4-10(16)5-2-8/h1-7,13,17H
InChi Info:
AuxInfo=1/0/N:1,5,9,2,4,10,13,6,8,3,11,12,7,15,14,17,16/E:(1,2)(4,5)/rA:17cCCCCCCCCCCCCCClClOF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;d9;s10;d11;d8s12;s12;s11;s7;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H9Cl2FO
All Atoms:26
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:7.72048
Area:430.213
Solvation:-3.03484
Coulombic:-23.5893
Bond Count [?]
All:18
Single:12
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:271.114
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.19
LogP (Chemaxon):4.53

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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