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23259-98-5 | Phosphonium, triphenyl(2-thienylmethyl)-, bromide (1:1)
CAS No: 23259-98-5 Catalog No: AG002MOQ MDL No:
Product Description
Catalog Number:
AG002MOQ
Chemical Name:
Phosphonium, triphenyl(2-thienylmethyl)-, bromide (1:1)
CAS Number:
23259-98-5
Molecular Formula:
C23H20BrPS
Molecular Weight:
439.3477
IUPAC Name:
triphenyl(thiophen-2-ylmethyl)phosphanium;bromide
InChI:
InChI=1S/C23H20PS.BrH/c1-4-11-20(12-5-1)24(19-23-17-10-18-25-23,21-13-6-2-7-14-21)22-15-8-3-9-16-22;/h1-18H,19H2;1H/q+1;/p-1
InChI Key:
PJQVALHFZIYJMT-UHFFFAOYSA-M
SMILES:
c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)Cc1cccs1.[Br-]
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.021g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
439.351g/mol
Monoisotopic Mass:
438.021g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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