5-(2-Bromo-phenyl)-2H-tetrazole

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Catalog Number
ACM73096421
Product Name
5-(2-Bromo-phenyl)-2H-tetrazole
Structure
Structure
CAS
73096-42-1
Category
Other
IUPAC Name
5-(2-bromophenyl)-2H-tetrazole
Molecular Weight
225.0473
Molecular Formula
C7H5BrN4
Canonical SMILES
C1=CC=C(C(=C1)C2=NNN=N2)Br
InChI
InChI=1S/C7H5BrN4/c8-6-4-2-1-3-5(6)7-9-11-12-10-7/h1-4H,(H,9,10,11,12)
InChI Key
YHVBXKTXLJTDRI-UHFFFAOYSA-N
Complexity
154
Covalently-Bonded Unit Count
1
Exact Mass
223.96976g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
12
MDL Number
MFCD06739096
Monoisotopic Mass
223.96976g/mol
Rotatable Bond Count
1
Size
5g,25g
XLogP3
1.8
MSDS
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COA
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Spec Sheet
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