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89739-99-1 | 2-Oxazolidinone, 5-[(acetyloxy)methyl]-3-(1,1-dimethylethyl)-, (S)-
CAS No: 89739-99-1 Catalog No: AG004167 MDL No:
Product Description
Catalog Number:
AG004167
Chemical Name:
2-Oxazolidinone, 5-[(acetyloxy)methyl]-3-(1,1-dimethylethyl)-, (S)-
CAS Number:
89739-99-1
Molecular Formula:
C10H17NO4
Molecular Weight:
215.2463
IUPAC Name:
(3-tert-butyl-2-oxo-1,3-oxazolidin-5-yl)methyl acetate
InChI:
InChI=1S/C10H17NO4/c1-7(12)14-6-8-5-11(9(13)15-8)10(2,3)4/h8H,5-6H2,1-4H3
InChI Key:
BHFMAFLKBRHNKS-UHFFFAOYSA-N
SMILES:
CC(=O)OC[C@H]1OC(=O)N(C1)C(C)(C)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.249g/mol
Monoisotopic Mass:
215.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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