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86970-75-4 | 2,4-Oxazolidinedione, 5,5-dimethyl-3-[2-(2-thienyl)ethyl]-
CAS No: 86970-75-4 Catalog No: AG008E78 MDL No:
Product Description
Catalog Number:
AG008E78
Chemical Name:
2,4-Oxazolidinedione, 5,5-dimethyl-3-[2-(2-thienyl)ethyl]-
CAS Number:
86970-75-4
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
IUPAC Name:
5,5-dimethyl-3-(2-thiophen-2-ylethyl)-1,3-oxazolidine-2,4-dione
InChI:
InChI=1S/C11H13NO3S/c1-11(2)9(13)12(10(14)15-11)6-5-8-4-3-7-16-8/h3-4,7H,5-6H2,1-2H3
InChI Key:
BFIKWPKERYVGKS-UHFFFAOYSA-N
SMILES:
O=C1OC(C(=O)N1CCc1cccs1)(C)C
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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