1,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid - CAS 1249563-59-4
Catalog: |
BB073012 |
Product Name: |
1,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid |
CAS: |
1249563-59-4 |
Synonyms: |
1,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid; 1,2-dimethyl-3-oxo-2,4-dihydroquinoxaline-6-carboxylic acid; 1,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylicacid |
IUPAC Name: | 1,2-dimethyl-3-oxo-2,4-dihydroquinoxaline-6-carboxylic acid |
Description: | 1,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid (cas# 1249563-59-4) is a useful research chemical. |
Molecular Weight: | 220.22 |
Molecular Formula: | C11H12N2O3 |
Canonical SMILES: | CC1C(=O)NC2=C(N1C)C=CC(=C2)C(=O)O |
InChI: | InChI=1S/C11H12N2O3/c1-6-10(14)12-8-5-7(11(15)16)3-4-9(8)13(6)2/h3-6H,1-2H3,(H,12,14)(H,15,16) |
InChI Key: | VKXLCBOIMMOFDA-UHFFFAOYSA-N |
Melting Point: | >243°C (dec.) |
Solubility: | Aqueous Base (Slightly), DMSO (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C, Inert atmosphere |
Complexity: | 318 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.08479225 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 69.6Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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