200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 112309-63-4
112309-63-4 | 1H-Isoindole-1,3(2H)-dione, 5,5'-carbonylbis[2-octadecyl-
CAS No: 112309-63-4 Catalog No: AG007BGD MDL No:
Product Description
Catalog Number:
AG007BGD
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 5,5'-carbonylbis[2-octadecyl-
CAS Number:
112309-63-4
Molecular Formula:
C53H80N2O5
Molecular Weight:
825.2127
IUPAC Name:
2-octadecyl-5-(2-octadecyl-1,3-dioxoisoindole-5-carbonyl)isoindole-1,3-dione
InChI:
InChI=1S/C53H80N2O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-54-50(57)45-37-35-43(41-47(45)52(54)59)49(56)44-36-38-46-48(42-44)53(60)55(51(46)58)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-38,41-42H,3-34,39-40H2,1-2H3
InChI Key:
CIQXBMTYKOOACF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCN1C(=O)c2c(C1=O)cc(cc2)C(=O)c1ccc2c(c1)C(=O)N(C2=O)CCCCCCCCCCCCCCCCCC
Properties
Complexity:
1160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
824.607g/mol
Formal Charge:
0
Heavy Atom Count:
60
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
825.232g/mol
Monoisotopic Mass:
824.607g/mol
Rotatable Bond Count:
36
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
18.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.