2,2,8-Trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylic acid

Base Information

• Chemical Name: 2,2,8-Trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylic acid
• CAS No.: 2027-66-9
• Molecular Formula: C₁₁H₁₃NO₄
• Molecular Weight: 223.229
• European Community (EC) Number: 844-937-0
• NSC Number: 103695
• DSSTox Substance ID: DTXSID60295652
• Wikidata: Q82035693
• Mol file: 2027-66-9.mol

Synonyms:2027-66-9;2,2,8-trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylic acid;4H-1,3-Dioxino[4,5-c]pyridine-5-carboxylic acid, 2,2,8-trimethyl-;2,2,8-Trimethyl-2H,4H-[1,3]dioxino[4,5-c]pyridine-5-carboxylic acid;NSC103695;NCIOpen2_007128;SCHEMBL4913458;DTXSID60295652;QSONXALUWRRCGU-UHFFFAOYSA-N;CAA02766;NSC-103695;EN300-1387025;Z2412197367;2,2,8-trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylicacid

Chemical Property of 2,2,8-Trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 3.68E-06mmHg at 25°C
• Boiling Point: 371°C at 760 mmHg
• Flash Point: 178.2°C
• PSA: 68.65000
• Density: 1.248g/cm³
• LogP: 1.73330
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 223.08445790
• Heavy Atom Count: 16
• Complexity: 292

Purity/Quality:

99% ^*data from raw suppliers

2,2,8-Trimethyl-4h-[1,3]dioxino[4,5-c]pyridine-5-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=C(C2=C1OC(OC2)(C)C)C(=O)O