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73790-47-3 | P-NITROBENZYLTRIBUTYLPHOSPHONIUM IODIDE
CAS No: 73790-47-3 Catalog No: AG005KHZ MDL No:
Product Description
Catalog Number:
AG005KHZ
Chemical Name:
P-NITROBENZYLTRIBUTYLPHOSPHONIUM IODIDE
CAS Number:
73790-47-3
Molecular Formula:
C19H33INO2P
Molecular Weight:
465.3491
IUPAC Name:
tributyl-[(4-nitrophenyl)methyl]phosphanium;iodide
InChI:
InChI=1S/C19H33NO2P.HI/c1-4-7-14-23(15-8-5-2,16-9-6-3)17-18-10-12-19(13-11-18)20(21)22;/h10-13H,4-9,14-17H2,1-3H3;1H/q+1;/p-1
InChI Key:
XWXHHAWDCPFVBS-UHFFFAOYSA-M
SMILES:
CCCC[P+]([N+](=O)[O-])(CCCC)CCCCCc1ccccc1.[I-]
NSC Number:
221303
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
465.129g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
465.356g/mol
Monoisotopic Mass:
465.129g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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