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146924-92-7 | 2-Azetidinone, 3-hydroxy-4-phenyl-, (3S,4R)-
CAS No: 146924-92-7 Catalog No: AG001EG3 MDL No:
Product Description
Catalog Number:
AG001EG3
Chemical Name:
2-Azetidinone, 3-hydroxy-4-phenyl-, (3S,4R)-
CAS Number:
146924-92-7
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
IUPAC Name:
(3S,4R)-3-hydroxy-4-phenylazetidin-2-one
InChI:
InChI=1S/C9H9NO2/c11-8-7(10-9(8)12)6-4-2-1-3-5-6/h1-5,7-8,11H,(H,10,12)/t7-,8+/m1/s1
InChI Key:
FBZSDKXFQUKDLD-SFYZADRCSA-N
SMILES:
O[C@@H]1C(=O)N[C@@H]1c1ccccc1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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