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1260762-50-2

1260762-50-2 | 2-Pyrrolidinone, 3-[(3-chlorophenyl)methyl]-

CAS No: 1260762-50-2 Catalog No: AG000R51 MDL No:

Product Description

Catalog Number:
AG000R51
Chemical Name:
2-Pyrrolidinone, 3-[(3-chlorophenyl)methyl]-
CAS Number:
1260762-50-2
Molecular Formula:
C11H12ClNO
Molecular Weight:
209.6721
IUPAC Name:
3-[(3-chlorophenyl)methyl]pyrrolidin-2-one
InChI:
InChI=1S/C11H12ClNO/c12-10-3-1-2-8(7-10)6-9-4-5-13-11(9)14/h1-3,7,9H,4-6H2,(H,13,14)
InChI Key:
RLYPLWITWFFKAH-UHFFFAOYSA-N
SMILES:
O=C1NCCC1Cc1cccc(c1)Cl

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.673g/mol
Monoisotopic Mass:
209.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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