Home Halogens 1-(4-bromophenyl)-1H-tetrazol-5(2H)-one

1-(4-bromophenyl)-1H-tetrazol-5(2H)-one

CAS No.:
98556-14-0
Catalog Number:
AG01BJ3E
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BJ3E
Chemical Name:
1-(4-bromophenyl)-1H-tetrazol-5(2H)-one
CAS Number:
98556-14-0
MDL Number:
MFCD08705785
IUPAC Name:
4-(4-bromophenyl)-1H-tetrazol-5-one
InChI:
InChI=1S/C7H5BrN4O/c8-5-1-3-6(4-2-5)12-7(13)9-10-11-12/h1-4H,(H,9,11,13)
InChI Key:
ZMLOHCNJANXGOS-UHFFFAOYSA-N
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.965g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.048g/mol
Monoisotopic Mass:
239.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties