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2,2',2''-Phosphanetriyltris(4,5-dipropyl-1H-imidazole)

HCID 71322740
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Basic information

CAS
89210-52-6
Standard SMILES
CCCc1nc(P(c2nc(CCC)c(CCC)[nH]2)c2nc(CCC)c(CCC)[nH]2)[nH]c1CCC
InChIKey
KGKFPKXXFFBRIU-UHFFFAOYSA-N
Molecular formula
C27H45N6P
Average molar mass
484.7 g/mol
Monoisotopic mass
484.34433246

Names & identifiers

Preferred name
2,2',2''-Phosphanetriyltris(4,5-dipropyl-1H-imidazole)
IUPAC
tris(4,5-dipropyl-1H-imidazol-2-yl)phosphane

Names & synonyms

89210-52-6DTXSID607523912,2',2''-Phosphanetriyltris(4,5-dipropyl-1H-imidazole)RefChem:241948DTXCID50703135tris[4,5-dipropyl-2-imidazolyl]phosphine

Database identifiers

CAS
89210-52-6
PubChem CID
71322740
DTXSID
DTXSID60752391
Nikkaji
J1.690.880K

Properties

Computed structural properties

XLogP
7.2
Topological polar surface area
86 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
15
Heavy atoms
34
Formal charge
0
Complexity
489

Related reactions

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Compound notes

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