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88571-78-2 | Thiazole, 4-phenyl-2-(tetrahydro-2H-pyran-4-yl)-
CAS No: 88571-78-2 Catalog No: AG004BMX MDL No:
Product Description
Catalog Number:
AG004BMX
Chemical Name:
Thiazole, 4-phenyl-2-(tetrahydro-2H-pyran-4-yl)-
CAS Number:
88571-78-2
Molecular Formula:
C14H15NOS
Molecular Weight:
245.3400
IUPAC Name:
2-(oxan-4-yl)-4-phenyl-1,3-thiazole
InChI:
InChI=1S/C14H15NOS/c1-2-4-11(5-3-1)13-10-17-14(15-13)12-6-8-16-9-7-12/h1-5,10,12H,6-9H2
InChI Key:
PDVHEXJNTUVWMC-UHFFFAOYSA-N
SMILES:
O1CCC(CC1)c1scc(n1)c1ccccc1
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.087g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.34g/mol
Monoisotopic Mass:
245.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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