Chemical ID: 4953477

Cc1ccccc1OCc2ccc(cc2)Cl
Chemical ID:
4953477
Name [?]:
1-[(4-chlorophenyl)methoxy]-2-methyl-benzene
SMILES [?]:
Cc1ccccc1OCc2ccc(cc2)Cl
InChi [?]:
InChI=1/C14H13ClO/c1-11-4-2-3-5-14(11)16-10-12-6-8-13(15)9-7-12/h2-9H,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,3,6,11,15,12,14,9,2,10,13,7,16,8/E:(6,7)(8,9)/rA:16nCCCCCCCOCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13ClO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.5781
Area:425.606
Solvation:-2.06205
Coulombic:-10.8855
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:232.705
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.49
LogP (Chemaxon):4.56

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Descriptor Annotations

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