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101469-91-4

101469-91-4 | 2,5-Pyrrolidinedione, 3-hydroxy-1-(phenylmethyl)-, (3S)-

CAS No: 101469-91-4 Catalog No: AG0004JL MDL No:MFCD08275390

Product Description

Catalog Number:
AG0004JL
Chemical Name:
2,5-Pyrrolidinedione, 3-hydroxy-1-(phenylmethyl)-, (3S)-
CAS Number:
101469-91-4
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD08275390
IUPAC Name:
(3S)-1-benzyl-3-hydroxypyrrolidine-2,5-dione
InChI:
InChI=1S/C11H11NO3/c13-9-6-10(14)12(11(9)15)7-8-4-2-1-3-5-8/h1-5,9,13H,6-7H2/t9-/m0/s1
InChI Key:
VCPKAWKGCQTPCR-VIFPVBQESA-N
SMILES:
O[C@H]1CC(=O)N(C1=O)Cc1ccccc1

Properties

Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

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