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132399-87-2 | Sulfonium, [3-(9-anthracenyl)propyl]diphenyl-
CAS No: 132399-87-2 Catalog No: AG0010N8 MDL No:
Product Description
Catalog Number:
AG0010N8
Chemical Name:
Sulfonium, [3-(9-anthracenyl)propyl]diphenyl-
CAS Number:
132399-87-2
Molecular Formula:
C29H25S+
Molecular Weight:
405.5738
IUPAC Name:
3-anthracen-9-ylpropyl(diphenyl)sulfanium
InChI:
InChI=1S/C29H25S/c1-3-14-25(15-4-1)30(26-16-5-2-6-17-26)21-11-20-29-27-18-9-7-12-23(27)22-24-13-8-10-19-28(24)29/h1-10,12-19,22H,11,20-21H2/q+1
InChI Key:
KHLNDOWNDDVJCE-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)[S+](c1ccccc1)CCCc1c2ccccc2cc2c1cccc2
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
405.168g/mol
Formal Charge:
1
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.579g/mol
Monoisotopic Mass:
405.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
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