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Home > Indoles and Oxindole > 6437-31-6
6437-31-6 | Pyrrolidine, 1-(5H-1,3-dioxolo[4,5-f]indol-7-yloxoacetyl)-
CAS No: 6437-31-6 Catalog No: AG00H89X MDL No:
Product Description
Catalog Number:
AG00H89X
Chemical Name:
Pyrrolidine, 1-(5H-1,3-dioxolo[4,5-f]indol-7-yloxoacetyl)-
CAS Number:
6437-31-6
Molecular Formula:
C15H14N2O4
Molecular Weight:
286.2827
IUPAC Name:
1-(5H-[1,3]dioxolo[4,5-f]indol-7-yl)-2-pyrrolidin-1-ylethane-1,2-dione
InChI:
InChI=1S/C15H14N2O4/c18-14(15(19)17-3-1-2-4-17)10-7-16-11-6-13-12(5-9(10)11)20-8-21-13/h5-7,16H,1-4,8H2
InChI Key:
OETHBMCWBJQEMU-UHFFFAOYSA-N
SMILES:
O=C(C(=O)c1c[nH]c2c1cc1OCOc1c2)N1CCCC1
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.287g/mol
Monoisotopic Mass:
286.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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