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Home > Indoles and Oxindole > 113460-09-6
113460-09-6 | 5H-Benzo[b]phosphindolium, 5,5-dibutyl-, iodide (1:1)
CAS No: 113460-09-6 Catalog No: AG0008OA MDL No:
Product Description
Catalog Number:
AG0008OA
Chemical Name:
5H-Benzo[b]phosphindolium, 5,5-dibutyl-, iodide (1:1)
CAS Number:
113460-09-6
Molecular Formula:
C20H26IP
Molecular Weight:
424.2987
IUPAC Name:
5,5-dibutylbenzo[b]phosphindol-5-ium;iodide
InChI:
InChI=1S/C20H26P.HI/c1-3-5-15-21(16-6-4-2)19-13-9-7-11-17(19)18-12-8-10-14-20(18)21;/h7-14H,3-6,15-16H2,1-2H3;1H/q+1;/p-1
InChI Key:
IYJNCQIUNTYJOO-UHFFFAOYSA-M
SMILES:
CCCC[P+]1(CCCC)c2ccccc2c2c1cccc2.[I-]
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.082g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
424.306g/mol
Monoisotopic Mass:
424.082g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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