200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 105981-42-8
105981-42-8 | 4,7-Ethano-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-oxiranylethyl)-
CAS No: 105981-42-8 Catalog No: AG0084N8 MDL No:
Product Description
Catalog Number:
AG0084N8
Chemical Name:
4,7-Ethano-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-oxiranylethyl)-
CAS Number:
105981-42-8
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
IUPAC Name:
4-[2-(oxiran-2-yl)ethyl]-4-azatricyclo[5.2.2.02,6]undecane-3,5-dione
InChI:
InChI=1S/C14H19NO3/c16-13-11-8-1-2-9(4-3-8)12(11)14(17)15(13)6-5-10-7-18-10/h8-12H,1-7H2
InChI Key:
SDUYQCARUCLKLE-UHFFFAOYSA-N
SMILES:
O=C1N(CCC2CO2)C(=O)C2C1C1CCC2CC1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.