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1028454-88-7 | ((Benzo[d]thiazol-2-ylsulfinyl)methyl)diphenylphosphine oxide
CAS No: 1028454-88-7 Catalog No: AG01ECOE MDL No:
Product Description
Catalog Number:
AG01ECOE
Chemical Name:
((Benzo[d]thiazol-2-ylsulfinyl)methyl)diphenylphosphine oxide
CAS Number:
1028454-88-7
IUPAC Name:
2-(diphenylphosphorylmethylsulfinyl)-1,3-benzothiazole
InChI:
InChI=1S/C20H16NO2PS2/c22-24(16-9-3-1-4-10-16,17-11-5-2-6-12-17)15-26(23)20-21-18-13-7-8-14-19(18)25-20/h1-14H,15H2
InChI Key:
MXJJHCFXGVXYNS-UHFFFAOYSA-N
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.036g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
397.447g/mol
Monoisotopic Mass:
397.036g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
94.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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