sodium 3-methylquinoxaline-2-carboxylate - CAS 1134616-77-5
Catalog: |
BB003184 |
Product Name: |
sodium 3-methylquinoxaline-2-carboxylate |
CAS: |
1134616-77-5 |
Synonyms: |
sodium;3-methyl-2-quinoxalinecarboxylate; sodium;3-methylquinoxaline-2-carboxylate |
IUPAC Name: | sodium;3-methylquinoxaline-2-carboxylate |
Description: | sodium 3-methylquinoxaline-2-carboxylate (CAS# 1134616-77-5 ) is a useful research chemical. |
Molecular Weight: | 210.168 |
Molecular Formula: | C10H7N2NaO2 |
Canonical SMILES: | CC1=NC2=CC=CC=C2N=C1C(=O)[O-].[Na+] |
InChI: | InChI=1S/C10H8N2O2.Na/c1-6-9(10(13)14)12-8-5-3-2-4-7(8)11-6;/h2-5H,1H3,(H,13,14);/q;+1/p-1 |
InChI Key: | MKTKKQJBTCKSPH-UHFFFAOYSA-M |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.04052175 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.04052175 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 65.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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