3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole
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![3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/85577afd8bb44de28b74138caf4d7451.png "3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole")
3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole
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CAS No:
17843-23-1
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Formula:
C10H11BrN4
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Chemical Name:
3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole
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Synonyms:
NSC168871;17843-23-1;1-(4-Bromophenyl)-1,3a,4,5,6,6a-hexahydropyrrolo(3,4-d)(1,2,3)triazole;1-(4-Bromophenyl)-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-d][1,2,3]triazole;NSC 168871;3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole;DTXSID40939082;NSC-168871
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CAS No:
3-(4-bromophenyl)-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]triazole Basic Attributes
267.13 g/mol
266.01671 g/mol
168871
Computed Properties
Molecular Weight:267.13
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:266.01671
Monoisotopic Mass:266.01671
Topological Polar Surface Area:40
Heavy Atom Count:15
Complexity:262
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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