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Home > Indoles and Oxindole > 69089-16-3
69089-16-3 | 2-Cyclopenten-1-one, 3-(6,7-dihydro-5H-1,3-dioxolo[4,5-f]indol-5-yl)-
CAS No: 69089-16-3 Catalog No: AG006CXQ MDL No:
Product Description
Catalog Number:
AG006CXQ
Chemical Name:
2-Cyclopenten-1-one, 3-(6,7-dihydro-5H-1,3-dioxolo[4,5-f]indol-5-yl)-
CAS Number:
69089-16-3
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
IUPAC Name:
3-(6,7-dihydro-[1,3]dioxolo[4,5-f]indol-5-yl)cyclopent-2-en-1-one
InChI:
InChI=1S/C14H13NO3/c16-11-2-1-10(6-11)15-4-3-9-5-13-14(7-12(9)15)18-8-17-13/h5-7H,1-4,8H2
InChI Key:
PHYOAAXHCRVVBN-UHFFFAOYSA-N
SMILES:
O=C1CCC(=C1)N1CCc2c1cc1OCOc1c2
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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