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89207-54-5 | Phosphonium, [3-[bis(1-methylethyl)amino]propyl]triphenyl-
CAS No: 89207-54-5 Catalog No: AG0045HF MDL No:
Product Description
Catalog Number:
AG0045HF
Chemical Name:
Phosphonium, [3-[bis(1-methylethyl)amino]propyl]triphenyl-
CAS Number:
89207-54-5
Molecular Formula:
C27H35NP+
Molecular Weight:
404.5473
IUPAC Name:
3-[di(propan-2-yl)amino]propyl-triphenylphosphanium
InChI:
InChI=1S/C27H35NP/c1-23(2)28(24(3)4)21-14-22-29(25-15-8-5-9-16-25,26-17-10-6-11-18-26)27-19-12-7-13-20-27/h5-13,15-20,23-24H,14,21-22H2,1-4H3/q+1
InChI Key:
ZJVVLPLTFUCPGO-UHFFFAOYSA-N
SMILES:
CC(N(C(C)C)CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.251g/mol
Formal Charge:
1
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.558g/mol
Monoisotopic Mass:
404.251g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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