Home Halogens 1-(6-bromopyridin-2-yl)-1H-1,3-benzodiazole

1-(6-bromopyridin-2-yl)-1H-1,3-benzodiazole

CAS No.:
1042224-74-7
Catalog Number:
AG01C007
Molecular Formula:
C12H8BrN3
Molecular Weight:
274.1160
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Product Description
Catalog Number:
AG01C007
Chemical Name:
1-(6-bromopyridin-2-yl)-1H-1,3-benzodiazole
CAS Number:
1042224-74-7
Molecular Formula:
C12H8BrN3
Molecular Weight:
274.1160
MDL Number:
MFCD19620355
IUPAC Name:
1-(6-bromopyridin-2-yl)benzimidazole
InChI:
InChI=1S/C12H8BrN3/c13-11-6-3-7-12(15-11)16-8-14-9-4-1-2-5-10(9)16/h1-8H
InChI Key:
ZEYZHHCLPZIWLB-UHFFFAOYSA-N
SMILES:
Brc1cccc(n1)n1cnc2c1cccc2
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.99g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.121g/mol
Monoisotopic Mass:
272.99g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties