5-Methoxyisophthalic Acid , >98.0%(GC) , 46331-50-4

CAS NO.：46331-50-4

Empirical Formula: C9H8O5

Molecular Weight: 196.16

MDL number: MFCD00272364

PRODUCT Properties

• Melting point: 275-280 °C (lit.)
• Boiling point: 270 °C
• Density: 1.416±0.06 g/cm3(Predicted)
• storage temp.: Sealed in dry,Room Temperature
• solubility: DMSO, Methanol
• form: Solid
• pka: 3.41±0.10(Predicted)
• color: Off-White
• InChI: 1S/C9H8O5/c1-14-7-3-5(8(10)11)2-6(4-7)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)
• InChIKey: POSMIIJADZKUPL-UHFFFAOYSA-N
• SMILES: COc1cc(cc(c1)C(O)=O)C(O)=O
• CAS DataBase Reference: 46331-50-4(CAS DataBase Reference)

Description and Uses

5-Methoxyisophthalic acid (MeO-H₂ip) may be used to synthesize [bpp = 1,3-di(4-pyridyl)propane]:

• 5-methoxy bis(4-benzyloxy)phenylisophthalate
• 3,5-bis(4-fluorobenzoyl)phenol
• [Cd₂(MeO-ip)₂(bpp)₂]_n·nH₂O
• [Ni(MeO-ip)(bpp)(H₂O)]_n·nH₂O

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319
• Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
• PPE: Eyeshields, Gloves, type N95 (US)
• Safety Statements: 24/25
• WGK Germany: 3
• HS Code: 29189900
• Storage Class: 13 - Non Combustible Solids