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88067-05-4 | 2,5-Pyrrolidinedione, 1-(3,5-dichlorophenyl)-3-(2-methoxyethyl)-
CAS No: 88067-05-4 Catalog No: AG004EY6 MDL No:
Product Description
Catalog Number:
AG004EY6
Chemical Name:
2,5-Pyrrolidinedione, 1-(3,5-dichlorophenyl)-3-(2-methoxyethyl)-
CAS Number:
88067-05-4
Molecular Formula:
C13H13Cl2NO3
Molecular Weight:
302.1532
IUPAC Name:
1-(3,5-dichlorophenyl)-3-(2-methoxyethyl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C13H13Cl2NO3/c1-19-3-2-8-4-12(17)16(13(8)18)11-6-9(14)5-10(15)7-11/h5-8H,2-4H2,1H3
InChI Key:
OMNIQSJAXQJBNJ-UHFFFAOYSA-N
SMILES:
COCCC1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.027g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.151g/mol
Monoisotopic Mass:
301.027g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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