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Home > Nitro Compounds > 13098-46-9
13098-46-9 | Decanedioic acid, 1,10-bis(4-nitrophenyl) ester
CAS No: 13098-46-9 Catalog No: AG000V80 MDL No:
Product Description
Catalog Number:
AG000V80
Chemical Name:
Decanedioic acid, 1,10-bis(4-nitrophenyl) ester
CAS Number:
13098-46-9
Molecular Formula:
C22H24N2O8
Molecular Weight:
444.4346
IUPAC Name:
bis(4-nitrophenyl) decanedioate
InChI:
InChI=1S/C22H24N2O8/c25-21(31-19-13-9-17(10-14-19)23(27)28)7-5-3-1-2-4-6-8-22(26)32-20-15-11-18(12-16-20)24(29)30/h9-16H,1-8H2
InChI Key:
AUIWXGZFQGLDHF-UHFFFAOYSA-N
SMILES:
O=C(Oc1ccc(cc1)[N+](=O)[O-])CCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.153g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
444.44g/mol
Monoisotopic Mass:
444.153g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
Literature
| Title | Journal |
|---|---|
| Biodegradable functional poly(ester amide)s with pendant hydroxyl functional groups: synthesis, characterization, fabrication and in vitro cellular response. | Acta biomaterialia 20110401 |
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