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5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole

5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole structure

CAS No:
92712-35-1
Formula:
C8H11I3N4
Chemical Name:
5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole
Synonyms:
2-(2',3',3'-triiodoallyl)-5-tert.-butyltetrazole;5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole;CHEMBL152646;SCHEMBL10730366;92712-35-1;5-tert-butyl-2-(2,3,3-triiodoallyl)tetrazole;2H-Tetrazole, 5-(1,1-dimethylethyl)-2-(2,3,3-triiodo-2-propenyl)-

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5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole Basic Attributes

Molecular Weight：

543.91 g/mol

Exact Mass：

543.8118 g/mol

Characteristics

PSA：

43.6 Å²

XLogP3：

3.4447

Melting Point：

108 - 111 °C (methanol)

Computed Properties

Molecular Weight:543.91
XLogP3:4.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:543.8118
Monoisotopic Mass:543.8118
Topological Polar Surface Area:43.6
Heavy Atom Count:15
Complexity:257
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-tert-butyl-2-(2,3,3-triiodoprop-2-enyl)tetrazole

Basic Attributes
Characteristics
Computed Properties

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