Text Search
Structure Search

sodium 3-methylquinoxaline-2-carboxylate

sodium 3-methylquinoxaline-2-carboxylate

CAS: 1134616-77-5

Formula: C10H7N2NaO2

SMILES: [Na+].CC1=NC2=CC=CC=C2N=C1C([O-])=O

IUPAC: sodium 3-methylquinoxaline-2-carboxylate

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

Composition: C (57.15%), H (3.36%), N (13.33%), Na (10.94%), O (15.22%)

Molar Mass: 210.168

Atom Count: 22

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 210.04052175
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey MKTKKQJBTCKSPH-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 59.76
Topological Polar Surface Area 65.91
Polarizability 20.05
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1134616-77-5 $51.35-$898.04$51.35$63.37$86.31$898.04
Request Quote