200,000+ products from a single source!
sales@angenechem.com
79664-58-7 | 5,8-Isoquinolinedione,7-methoxy-1,6-dimethyl-
CAS No: 79664-58-7 Catalog No: AG0057LE MDL No:
Product Description
Catalog Number:
AG0057LE
Chemical Name:
5,8-Isoquinolinedione,7-methoxy-1,6-dimethyl-
CAS Number:
79664-58-7
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
7-methoxy-1,6-dimethylisoquinoline-5,8-dione
InChI:
InChI=1S/C12H11NO3/c1-6-10(14)8-4-5-13-7(2)9(8)11(15)12(6)16-3/h4-5H,1-3H3
InChI Key:
CYEQNCOGYHCBOC-UHFFFAOYSA-N
SMILES:
COC1=C(C)C(=O)c2c(C1=O)c(C)ncc2
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Comparative study on biological activities of heterocyclic quinones and streptonigrin. | The Journal of antibiotics 19870501 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.