Home Halogens 5-bromo-2-(pyridin-2-yl)-1H-1,3-benzodiazole

5-bromo-2-(pyridin-2-yl)-1H-1,3-benzodiazole

CAS No.:
1304458-60-3
Catalog Number:
AG01A3Y2
Molecular Formula:
C12H8BrN3
Molecular Weight:
274.1160
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Product Description
Catalog Number:
AG01A3Y2
Chemical Name:
5-bromo-2-(pyridin-2-yl)-1H-1,3-benzodiazole
CAS Number:
1304458-60-3
Molecular Formula:
C12H8BrN3
Molecular Weight:
274.1160
MDL Number:
MFCD20403487
IUPAC Name:
6-bromo-2-pyridin-2-yl-1H-benzimidazole
InChI:
InChI=1S/C12H8BrN3/c13-8-4-5-9-11(7-8)16-12(15-9)10-3-1-2-6-14-10/h1-7H,(H,15,16)
InChI Key:
UPORMWWQCXNWOP-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)nc([nH]2)c1ccccn1
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:
1  
Isotope Atom Count:
0
Molecular Weight:
274.121g/mol
Monoisotopic Mass:
272.99g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties