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142763-11-9 | 2-Oxazolidinone, 4-[(3,4-dimethoxyphenyl)methyl]-, (S)-
CAS No: 142763-11-9 Catalog No: AG007ZAL MDL No:
Product Description
Catalog Number:
AG007ZAL
Chemical Name:
2-Oxazolidinone, 4-[(3,4-dimethoxyphenyl)methyl]-, (S)-
CAS Number:
142763-11-9
Molecular Formula:
C12H15NO4
Molecular Weight:
237.2518
IUPAC Name:
(4S)-4-[(3,4-dimethoxyphenyl)methyl]-1,3-oxazolidin-2-one
InChI:
InChI=1S/C12H15NO4/c1-15-10-4-3-8(6-11(10)16-2)5-9-7-17-12(14)13-9/h3-4,6,9H,5,7H2,1-2H3,(H,13,14)/t9-/m0/s1
InChI Key:
PRMCYVGOYNBROE-VIFPVBQESA-N
SMILES:
COc1cc(ccc1OC)C[C@H]1COC(=O)N1
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
237.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.255g/mol
Monoisotopic Mass:
237.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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