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7144-43-6 | 2,5-Pyrrolidinedione,3-(1,2-dimethyl-1H-indol-3-yl)-
CAS No: 7144-43-6 Catalog No: AG006805 MDL No:
Product Description
Catalog Number:
AG006805
Chemical Name:
2,5-Pyrrolidinedione,3-(1,2-dimethyl-1H-indol-3-yl)-
CAS Number:
7144-43-6
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
IUPAC Name:
3-(1,2-dimethylindol-3-yl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C14H14N2O2/c1-8-13(10-7-12(17)15-14(10)18)9-5-3-4-6-11(9)16(8)2/h3-6,10H,7H2,1-2H3,(H,15,17,18)
InChI Key:
KRLNMNCESXDUSP-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(C1)c1c(C)n(c2c1cccc2)C
NSC Number:
69613
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.278g/mol
Monoisotopic Mass:
242.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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