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89756-67-2

89756-67-2 | 2,5-Pyrrolidinedione, 1-(2-chloroethyl)-3-phenyl-

CAS No: 89756-67-2 Catalog No: AG0040AZ MDL No:

Product Description

Catalog Number:
AG0040AZ
Chemical Name:
2,5-Pyrrolidinedione, 1-(2-chloroethyl)-3-phenyl-
CAS Number:
89756-67-2
Molecular Formula:
C12H12ClNO2
Molecular Weight:
237.6822
IUPAC Name:
1-(2-chloroethyl)-3-phenylpyrrolidine-2,5-dione
InChI:
InChI=1S/C12H12ClNO2/c13-6-7-14-11(15)8-10(12(14)16)9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
NISBOHSZFWVSQO-UHFFFAOYSA-N
SMILES:
ClCCN1C(=O)CC(C1=O)c1ccccc1

Properties

Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.056g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.683g/mol
Monoisotopic Mass:
237.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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