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110380-32-0 | Oxazole, 5-(4-methylphenyl)-2-(2-thienyl)-
CAS No: 110380-32-0 Catalog No: AG0083YM MDL No:
Product Description
Catalog Number:
AG0083YM
Chemical Name:
Oxazole, 5-(4-methylphenyl)-2-(2-thienyl)-
CAS Number:
110380-32-0
Molecular Formula:
C14H11NOS
Molecular Weight:
241.3082
IUPAC Name:
5-(4-methylphenyl)-2-thiophen-2-yl-1,3-oxazole
InChI:
InChI=1S/C14H11NOS/c1-10-4-6-11(7-5-10)12-9-15-14(16-12)13-3-2-8-17-13/h2-9H,1H3
InChI Key:
HHYSFJVMZQQFDV-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cnc(o1)c1cccs1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.308g/mol
Monoisotopic Mass:
241.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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