Chemical ID: 4727163

c1ccc2c(c1)[nH]c(n2)Br
Chemical ID:
4727163
Name [?]:
2-bromo-1H-benzoimidazole
SMILES [?]:
c1ccc2c(c1)[nH]c(n2)Br
InChi [?]:
InChI=1/C7H5BrN2/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,8,10,7,9/E:(1,2)(3,4)(5,6)(9,10)/rA:10nCCCCCCNCNBr/rB:s1;d2;s3;d4;d1s5;s5;s7;s4d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H5BrN2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.39476
Area:291.087
Solvation:-0.882416
Coulombic:-18.5256
Bond Count [?]
All:11
Single:7
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:197.032
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.12
LogP (Chemaxon):2.95

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