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1,3,5-Diazaphosphorine, hexahydro-1,3-bis(4-bromophenyl)-5-phenyl-, 5-selenide

HCID 3067413
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Basic information

CAS
81439-70-5
Standard SMILES
[Se]=P1(c2ccccc2)CN(c2ccc(Br)cc2)CN(c2ccc(Br)cc2)C1
InChIKey
VUTBXPATQUECFS-UHFFFAOYSA-N
Molecular formula
C21H19Br2N2PSe
Average molar mass
569.1 g/mol
Monoisotopic mass
567.88178

Names & identifiers

Preferred name
1,3,5-Diazaphosphorine, hexahydro-1,3-bis(4-bromophenyl)-5-phenyl-, 5-selenide
IUPAC
1,3-bis(4-bromophenyl)-5-phenyl-5-selanylidene-1,3,5λ5-diazaphosphinane

Names & synonyms

BRN 513612581439-70-51,3,5-Diazaphosphorine, hexahydro-1,3-bis(4-bromophenyl)-5-phenyl-, 5-selenideHexahydro-1,3-bis(4-bromophenyl)-5-phenyl-1,3,5-diazaphosphorine 5-selenideDTXSID90231109RefChem:217174DTXCID401536001,3-Bis(4-bromophenyl)-5-phenyl-1,3,5-diazaphosphinane 5-selenide1,3-Bis(4-bromophenyl)-5-phenyl-1,3,5lambda~5~-diazaphosphinane-5-selone

Database identifiers

CAS
81439-70-5
PubChem CID
3067413
DTXSID
DTXSID90231109

Properties

Computed structural properties

Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
27
Formal charge
0
Complexity
492

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Compound notes

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