Chemical ID: 4954425

c1ccc(cc1)c2cc(c3ccccc3n2)Br
Chemical ID:
4954425
Name [?]:
4-bromo-2-phenyl-quinoline
SMILES [?]:
c1ccc(cc1)c2cc(c3ccccc3n2)Br
InChi [?]:
InChI=1/C15H10BrN/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H
InChi Info:
AuxInfo=1/0/N:1,2,6,12,13,3,5,11,14,8,4,10,9,15,7,17,16/E:(2,3)(6,7)/rA:17nCCCCCCCCCCCCCCCNBr/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;s10;d11;s12;d13;d10s14;d7s15;s9;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10BrN
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.08893
Area:409.97
Solvation:-1.16033
Coulombic:-8.77931
Bond Count [?]
All:19
Single:11
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:284.151
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:4.95
LogP (Chemaxon):5.01

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Descriptor Annotations

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