Chemical ID: 4694084

c1cc(c(c(c1)Cl)COc2ccc(c(c2)F)N)Cl
Chemical ID:
4694084
Name [?]:
4-[(2,6-dichlorophenyl)methoxy]-2-fluoro-aniline
SMILES [?]:
c1cc(c(c(c1)Cl)COc2ccc(c(c2)F)N)Cl
InChi [?]:
InChI=1/C13H10Cl2FNO/c14-10-2-1-3-11(15)9(10)7-18-8-4-5-13(17)12(16)6-8/h1-6H,7,17H2
InChi Info:
AuxInfo=1/0/N:1,2,6,11,12,15,8,10,4,3,5,14,13,18,7,16,17,9/E:(2,3)(10,11)(14,15)/rA:18nCCCCCCClCOCCCCCCFNCl/rB:s1;d2;s3;d4;d1s5;s5;s4;s8;s9;s10;d11;s12;d13;d10s14;s14;s13;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10Cl2FNO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.24189
Area:446.379
Solvation:-2.91759
Coulombic:-30.0096
Bond Count [?]
All:19
Single:13
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:286.128
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:4.23
LogP (Chemaxon):3.96

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