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88697-65-8 | 2-Oxazolidinone, 5-(3,5-dichlorophenyl)-3-(1,1-dimethylethyl)-
CAS No: 88697-65-8 Catalog No: AG0046H7 MDL No:
Product Description
Catalog Number:
AG0046H7
Chemical Name:
2-Oxazolidinone, 5-(3,5-dichlorophenyl)-3-(1,1-dimethylethyl)-
CAS Number:
88697-65-8
Molecular Formula:
C13H15Cl2NO2
Molecular Weight:
288.1697
IUPAC Name:
3-tert-butyl-5-(3,5-dichlorophenyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H15Cl2NO2/c1-13(2,3)16-7-11(18-12(16)17)8-4-9(14)6-10(15)5-8/h4-6,11H,7H2,1-3H3
InChI Key:
JQASYPBAKKLINM-UHFFFAOYSA-N
SMILES:
CC(N1CC(OC1=O)c1cc(Cl)cc(c1)Cl)(C)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.048g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.168g/mol
Monoisotopic Mass:
287.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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