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2-[5-(3-bromophenyl)-2H-tetrazol-2-yl]pyridine

HCID 9857552
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Basic information

Standard SMILES
Brc1cccc(-c2nnn(-c3ccccn3)n2)c1
InChIKey
ZAAZGKSNZMKEFB-UHFFFAOYSA-N
Molecular formula
C12H8BrN5
Average molar mass
302.13 g/mol

Names & identifiers

Preferred name
2-[5-(3-bromophenyl)-2H-tetrazol-2-yl]pyridine
IUPAC
2-[5-(3-bromophenyl)tetrazol-2-yl]pyridine

Names & synonyms

2-[5-(3-bromophenyl)-2H-tetrazol-2-yl]pyridineSCHEMBL4700157ZAAZGKSNZMKEFB-UHFFFAOYSA-NSY525225507268-17-9

Database identifiers

PubChem CID
9857552

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
56.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
277

Related reactions

1 records
New reaction record
HRID 852318 reaction equation
HRID 852318As productuspto-grants-2007_08

Compound notes

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