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Home > Indoles and Oxindole > 25164-88-9
25164-88-9 | 2-Pyrrolidinone, 5-(1H-indol-3-yl)-
CAS No: 25164-88-9 Catalog No: AG002QPV MDL No:
Product Description
Catalog Number:
AG002QPV
Chemical Name:
2-Pyrrolidinone, 5-(1H-indol-3-yl)-
CAS Number:
25164-88-9
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
IUPAC Name:
5-(1H-indol-3-yl)pyrrolidin-2-one
InChI:
InChI=1S/C12H12N2O/c15-12-6-5-11(14-12)9-7-13-10-4-2-1-3-8(9)10/h1-4,7,11,13H,5-6H2,(H,14,15)
InChI Key:
KAFVVGYBPHAPPM-UHFFFAOYSA-N
SMILES:
O=C1CCC(N1)c1c[nH]c2c1cccc2
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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