3-Methylphthalaldehyde

Base Information

• Chemical Name: 3-Methylphthalaldehyde
• CAS No.: 147119-69-5
• Molecular Formula: C9H8 O2
• Molecular Weight: 148.15862
• Hs Code.: 2912290090
• DSSTox Substance ID: DTXSID90597277
• Wikidata: Q82492788
• Mol file: 147119-69-5.mol

Synonyms:3-Methylphthalaldehyde;147119-69-5;1,2-Benzenedicarboxaldehyde, 3-methyl- (9CI);3-methylbenzene-1,2-dicarbaldehyde;SCHEMBL548632;DTXSID90597277

Chemical Property of 3-Methylphthalaldehyde

Chemical Property:

• Vapor Pressure: 0.00342mmHg at 25°C
• Refractive Index: 1.607
• Boiling Point: 282.1°C at 760 mmHg
• Flash Point: 104.9°C
• PSA: 34.14000
• Density: 1.148g/cm³
• LogP: 1.62000
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 148.052429494
• Heavy Atom Count: 11
• Complexity: 154

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C=O)C=O