Chemical ID: 6674520

c1ccc(cc1)C=Cc2ccc(cc2)Br
Chemical ID:
6674520
Name [?]:
1-bromo-4-styryl-benzene
SMILES [?]:
c1ccc(cc1)C=Cc2ccc(cc2)Br
InChi [?]:
InChI=1/C14H11Br/c15-14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-11H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,7,8,10,14,11,13,4,9,12,15/E:(2,3)(4,5)(8,9)(10,11)/rA:15nCCCCCCCCCCCCCCBr/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11Br
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.66218
Area:376.488
Solvation:-0.750035
Coulombic:-4.65289
Bond Count [?]
All:16
Single:9
Double:7
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:259.141
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.45
LogP (Chemaxon):5.06

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