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88571-93-1 | Thiazole, 4-(4-methylphenyl)-2-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)-
CAS No: 88571-93-1 Catalog No: AG004BMT MDL No:
Product Description
Catalog Number:
AG004BMT
Chemical Name:
Thiazole, 4-(4-methylphenyl)-2-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)-
CAS Number:
88571-93-1
Molecular Formula:
C17H21NOS
Molecular Weight:
287.4197
IUPAC Name:
2-(2,2-dimethyloxan-4-yl)-4-(4-methylphenyl)-1,3-thiazole
InChI:
InChI=1S/C17H21NOS/c1-12-4-6-13(7-5-12)15-11-20-16(18-15)14-8-9-19-17(2,3)10-14/h4-7,11,14H,8-10H2,1-3H3
InChI Key:
DUFSIWNKJZPQGI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1csc(n1)C1CCOC(C1)(C)C
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.134g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.421g/mol
Monoisotopic Mass:
287.134g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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