Chemical ID: 4953470

Cc1ccccc1OCc2ccccc2Br
Chemical ID:
4953470
Name [?]:
1-[(2-bromophenyl)methoxy]-2-methyl-benzene
SMILES [?]:
Cc1ccccc1OCc2ccccc2Br
InChi [?]:
InChI=1/C14H13BrO/c1-11-6-2-5-9-14(11)16-10-12-7-3-4-8-13(12)15/h2-9H,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,12,13,5,3,11,14,6,9,2,10,15,7,16,8/rA:16nCCCCCCCOCCCCCCCBr/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13BrO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.65289
Area:410.731
Solvation:-1.61538
Coulombic:-11.0449
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:277.156
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.67
LogP (Chemaxon):4.83

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