2,6-Dimethylbenzoic acid

• Catalog Number: ACM632462
• Product Name: 2,6-Dimethylbenzoic acid
• CAS: 632-46-2
• Category: Solvents
• Synonyms: vic.-m-Xylylic acid
• IUPAC Name: 2,6-dimethylbenzoic acid
• Molecular Weight: 150.18
• Molecular Formula: C9H10O2
• Canonical SMILES: CC1=CC=CC(C)=C1C(O)=O
• InChI: 1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
• InChI Key: HCBHQDKBSKYGCK-UHFFFAOYSA-N
• Boiling Point: 272.8±9.0 °C at 760 mmHg
• Melting Point: 114-116 °C(lit.)
• Flash Point: 126.1±13.4 °C
• Density: 1.1±0.1 g/cm³
• Application: Crystal structure of 2,6-dimethylbenzoic acid was studied by three-dimensional X-ray methods.
• Assay: 0.97
• Beilstein: 1863791
• Color: White to cream
• EC Number: 211-177-0
• Exact Mass: 150.068085
• Form: Crystalline powder
• Hazard Codes: Xi:Irritant
• Hazard Statements: H315-H319-H335
• LogP: 2.82
• MDL Number: MFCD00002483
• NACRES: NA.22
• PSA: 37.3
• PubChem ID: 24849646
• Refractive Index: 1.55
• Vapor Pressure: 0.0±0.6 mmHg at 25°C
• WGK Germany: 3