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Home Other Building Blocks 2,8,9-Triisobutyl-2,5,8,9-tetraaza-1-phosphabicyclo[3.3.3]undecane

2,8,9-Triisobutyl-2,5,8,9-tetraaza-1-phosphabicyclo[3.3.3]undecane

CAS No.:
331465-71-5
Catalog Number:
AG00332B
Molecular Formula:
C18H39N4P
Molecular Weight:
342.5028
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$121
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Product Description
Catalog Number:
AG00332B
Chemical Name:
2,8,9-Triisobutyl-2,5,8,9-tetraaza-1-phosphabicyclo[3.3.3]undecane
CAS Number:
331465-71-5
Molecular Formula:
C18H39N4P
Molecular Weight:
342.5028
MDL Number:
MFCD03840347
IUPAC Name:
2,8,9-tris(2-methylpropyl)-2,5,8,9-tetraza-1-phosphabicyclo[3.3.3]undecane
InChI:
InChI=1S/C18H39N4P/c1-16(2)13-20-10-7-19-8-11-21(14-17(3)4)23(20)22(12-9-19)15-18(5)6/h16-18H,7-15H2,1-6H3
InChI Key:
WFHPXSHLCFHEIA-UHFFFAOYSA-N
SMILES:
CC(CN1CCN2CCN(P1N(CC2)CC(C)C)CC(C)C)C
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.291g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.512g/mol
Monoisotopic Mass:
342.291g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
13A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Literature
Title Journal
Syntheses and structural characterizations of anionic borane-capped ammonia borane oligomers: evidence for ammonia borane H2 release via a base-promoted anionic dehydropolymerization mechanism. Journal of the American Chemical Society 20111026
Properties