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147511-27-1 | 2-Oxazolidinone, 4-(1-methylethyl)-3-[(2E)-1-oxo-2-buten-1-yl]-, (4R)-
CAS No: 147511-27-1 Catalog No: AG001EXI MDL No:
Product Description
Catalog Number:
AG001EXI
Chemical Name:
2-Oxazolidinone, 4-(1-methylethyl)-3-[(2E)-1-oxo-2-buten-1-yl]-, (4R)-
CAS Number:
147511-27-1
Molecular Formula:
C10H15NO3
Molecular Weight:
197.2310
IUPAC Name:
3-but-2-enoyl-4-propan-2-yl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C10H15NO3/c1-4-5-9(12)11-8(7(2)3)6-14-10(11)13/h4-5,7-8H,6H2,1-3H3
InChI Key:
YZRHIMNEVFYTAJ-UHFFFAOYSA-N
SMILES:
C/C=C/C(=O)N1C(=O)OC[C@H]1C(C)C
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.105g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.234g/mol
Monoisotopic Mass:
197.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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