200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 104618-32-8
104618-32-8 | 2-(4-Oxocyclohexyl);isoindoline-1,3-dione
CAS No: 104618-32-8 Catalog No: AG007GXI MDL No:MFCD00158659
Product Description
Catalog Number:
AG007GXI
Chemical Name:
2-(4-Oxocyclohexyl);isoindoline-1,3-dione
CAS Number:
104618-32-8
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
MDL Number:
MFCD00158659
IUPAC Name:
2-(4-oxocyclohexyl)isoindole-1,3-dione
InChI:
InChI=1S/C14H13NO3/c16-10-7-5-9(6-8-10)15-13(17)11-3-1-2-4-12(11)14(15)18/h1-4,9H,5-8H2
InChI Key:
PWUJQPNLEZZILN-UHFFFAOYSA-N
SMILES:
O=C1N(C2CCC(=O)CC2)C(=O)c2c1cccc2
Properties
Complexity:
370
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:
3
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:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.