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649723-64-8 | 5-Oxazolidinone, 2-(1,1-dimethylethyl)-4-[2-(methylthio)ethyl]-, (2R,4R)-
CAS No: 649723-64-8 Catalog No: AG00H7J7 MDL No:
Product Description
Catalog Number:
AG00H7J7
Chemical Name:
5-Oxazolidinone, 2-(1,1-dimethylethyl)-4-[2-(methylthio)ethyl]-, (2R,4R)-
CAS Number:
649723-64-8
Molecular Formula:
C10H19NO2S
Molecular Weight:
217.3284
IUPAC Name:
(2R,4R)-2-tert-butyl-4-(2-methylsulfanylethyl)-1,3-oxazolidin-5-one
InChI:
InChI=1S/C10H19NO2S/c1-10(2,3)9-11-7(5-6-14-4)8(12)13-9/h7,9,11H,5-6H2,1-4H3/t7-,9-/m1/s1
InChI Key:
WFWLZDDHOUJCAP-VXNVDRBHSA-N
SMILES:
CSCC[C@H]1N[C@H](OC1=O)C(C)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
217.114g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.327g/mol
Monoisotopic Mass:
217.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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