Home Halogens 5-(5-bromofuran-2-yl)-1H-1,2,3,4-tetrazole

5-(5-bromofuran-2-yl)-1H-1,2,3,4-tetrazole

CAS No.:
121745-85-5
Catalog Number:
AG01EL43
Molecular Formula:
C5H3BrN4O
Molecular Weight:
215.0075
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Product Description
Catalog Number:
AG01EL43
Chemical Name:
5-(5-bromofuran-2-yl)-1H-1,2,3,4-tetrazole
CAS Number:
121745-85-5
Molecular Formula:
C5H3BrN4O
Molecular Weight:
215.0075
MDL Number:
MFCD09802168
IUPAC Name:
5-(5-bromofuran-2-yl)-2H-tetrazole
InChI:
InChI=1S/C5H3BrN4O/c6-4-2-1-3(11-4)5-7-9-10-8-5/h1-2H,(H,7,8,9,10)
InChI Key:
LMMDFBVXAZUOFU-UHFFFAOYSA-N
SMILES:
Brc1ccc(o1)c1nnn[nH]1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.949g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.01g/mol
Monoisotopic Mass:
213.949g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties