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201856-53-3 | 2-Azetidinone, 1-benzoyl-3-(1-ethoxyethoxy)-4-phenyl-, (3R,4S)-
CAS No: 201856-53-3 Catalog No: AG0027WI MDL No:MFCD09752076
Product Description
Catalog Number:
AG0027WI
Chemical Name:
2-Azetidinone, 1-benzoyl-3-(1-ethoxyethoxy)-4-phenyl-, (3R,4S)-
CAS Number:
201856-53-3
Molecular Formula:
C20H21NO4
Molecular Weight:
339.3850
MDL Number:
MFCD09752076
IUPAC Name:
(3R,4S)-1-benzoyl-3-(1-ethoxyethoxy)-4-phenylazetidin-2-one
InChI:
InChI=1S/C20H21NO4/c1-3-24-14(2)25-18-17(15-10-6-4-7-11-15)21(20(18)23)19(22)16-12-8-5-9-13-16/h4-14,17-18H,3H2,1-2H3/t14?,17-,18+/m0/s1
InChI Key:
XSYLUBKWRZCOQP-CXRLMVSZSA-N
SMILES:
CCOC(O[C@H]1C(=O)N([C@H]1c1ccccc1)C(=O)c1ccccc1)C
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
339.147g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.391g/mol
Monoisotopic Mass:
339.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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