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115754-95-5 | Thiazole, 2-[(triphenylphosphoranylidene)methyl]-
CAS No: 115754-95-5 Catalog No: AG000GTY MDL No:
Product Description
Catalog Number:
AG000GTY
Chemical Name:
Thiazole, 2-[(triphenylphosphoranylidene)methyl]-
CAS Number:
115754-95-5
Molecular Formula:
C22H18NPS
Molecular Weight:
359.4238
IUPAC Name:
triphenyl(1,3-thiazol-2-ylmethylidene)-λ5-phosphane
InChI:
InChI=1S/C22H18NPS/c1-4-10-19(11-5-1)24(18-22-23-16-17-25-22,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-18H
InChI Key:
ZKQXINTUSDIKSA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)P(=Cc1nccs1)(c1ccccc1)c1ccccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.09g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
359.427g/mol
Monoisotopic Mass:
359.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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