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188661-43-0 | Oxazolidine, 2-(1H-imidazol-2-yl)-4-phenyl-, (4R)-
CAS No: 188661-43-0 Catalog No: AG002H3O MDL No:
Product Description
Catalog Number:
AG002H3O
Chemical Name:
Oxazolidine, 2-(1H-imidazol-2-yl)-4-phenyl-, (4R)-
CAS Number:
188661-43-0
Molecular Formula:
C12H13N3O
Molecular Weight:
215.2511
IUPAC Name:
(4R)-2-(1H-imidazol-2-yl)-4-phenyl-1,3-oxazolidine
InChI:
InChI=1S/C12H13N3O/c1-2-4-9(5-3-1)10-8-16-12(15-10)11-13-6-7-14-11/h1-7,10,12,15H,8H2,(H,13,14)/t10-,12?/m0/s1
InChI Key:
YTCJHHWCONCDQB-NUHJPDEHSA-N
SMILES:
c1ccc(cc1)[C@@H]1COC(N1)c1ncc[nH]1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
215.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.256g/mol
Monoisotopic Mass:
215.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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