Chemical ID: 4118131

c1ccc(cc1)COc2ccc(cc2)F
Chemical ID:
4118131
Name [?]:
1-benzyloxy-4-fluoro-benzene
SMILES [?]:
c1ccc(cc1)COc2ccc(cc2)F
InChi [?]:
InChI=1/C13H11FO/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9H,10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,11,13,10,14,7,4,12,9,15,8/E:(2,3)(4,5)(6,7)(8,9)/rA:15nCCCCCCCOCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H11FO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.42735
Area:376.45
Solvation:-2.9839
Coulombic:-13.4373
Bond Count [?]
All:16
Single:10
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:202.224
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.81
LogP (Chemaxon):3.71

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Descriptor Annotations

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