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128242-93-3 | 5-Ethoxy-2-phenyloxazole-4-carbothioamide
CAS No: 128242-93-3 Catalog No: AG00AFO8 MDL No:
Product Description
Catalog Number:
AG00AFO8
Chemical Name:
5-Ethoxy-2-phenyloxazole-4-carbothioamide
CAS Number:
128242-93-3
IUPAC Name:
5-ethoxy-2-phenyl-1,3-oxazole-4-carbothioamide
InChI:
InChI=1S/C12H12N2O2S/c1-2-15-12-9(10(13)17)14-11(16-12)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,17)
InChI Key:
DHJOPXLDKYOMKT-UHFFFAOYSA-N
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.062g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.3g/mol
Monoisotopic Mass:
248.062g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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