Methyl 3,5-dimethoxybenzoate

• CAS: 2150-37-0
• Catalog Number: ACM-MO-2150370
• Category: Other Products; Dendrimer Building Blocks
• Molecular Weight: 196.2 g/mol
• Molecular Formula: C10H12O4
• Synonyms: Ethyl 3,5-dimethoxybenzoate
• IUPAC Name: methyl 3,5-dimethoxybenzoate
• Canonical SMILES: COC1=CC(=CC(=C1)C(=O)OC)OC
• InChI: InChI=1S/C10H12O4/c1-12-8-4-7(10(11)14-3)5-9(6-8)13-2/h4-6H,1-3H3
• InChI Key: YXUIOVUOFQKWDM-UHFFFAOYSA-N
• Boiling Point: 298 °C/lit.
• Melting Point: 42-43 °C (lit.)
• Appearance: White to Beige Powder or Granules
• Complexity: 181
• Covalently-Bonded Unit Count: 1
• EC Number: 218-423-6
• Exact Mass: 196.073559g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 14
• Monoisotopic Mass: 196.073559g/mol
• NSC Number: 65605
• Refractive Index: 1.5430 (estimate)
• Rotatable Bond Count: 4
• Specific Gravity: 1.12
• XLogP3: 2.1