Home Halogens 1-(2-bromo-4-chlorophenyl)-1H-1,2,3,4-tetrazole

1-(2-bromo-4-chlorophenyl)-1H-1,2,3,4-tetrazole

CAS No.:
1501463-24-6
Catalog Number:
AG01C0HA
Molecular Formula:
C7H4BrClN4
Molecular Weight:
259.4905
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Product Description
Catalog Number:
AG01C0HA
Chemical Name:
1-(2-bromo-4-chlorophenyl)-1H-1,2,3,4-tetrazole
CAS Number:
1501463-24-6
Molecular Formula:
C7H4BrClN4
Molecular Weight:
259.4905
MDL Number:
MFCD24078674
IUPAC Name:
1-(2-bromo-4-chlorophenyl)tetrazole
InChI:
InChI=1S/C7H4BrClN4/c8-6-3-5(9)1-2-7(6)13-4-10-11-12-13/h1-4H
InChI Key:
YXTXPITXKHTMDU-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Br)n1cnnn1
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.931g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.491g/mol
Monoisotopic Mass:
257.931g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties