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80465-37-8 | 2,5-Oxazolidinedione, 3-acetyl-4-(2-methylpropylidene)-, (Z)-
CAS No: 80465-37-8 Catalog No: AG0059MS MDL No:
Product Description
Catalog Number:
AG0059MS
Chemical Name:
2,5-Oxazolidinedione, 3-acetyl-4-(2-methylpropylidene)-, (Z)-
CAS Number:
80465-37-8
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
IUPAC Name:
3-acetyl-4-(2-methylpropylidene)-1,3-oxazolidine-2,5-dione
InChI:
InChI=1S/C9H11NO4/c1-5(2)4-7-8(12)14-9(13)10(7)6(3)11/h4-5H,1-3H3
InChI Key:
KNHYBLASXHWEBY-UHFFFAOYSA-N
SMILES:
CC(/C=C\1/C(=O)OC(=O)N1C(=O)C)C
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.19g/mol
Monoisotopic Mass:
197.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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