Methyl vanillate

CAS	3943-74-6
Structure
Synonyms	Vanillic acid methyl
IUPAC Name	Methyl 4-hydroxy-3-methoxybenzoate
Molecular Weight	182.17
Molecular Formula	C9H10O4
Canonical SMILES	COC1=C(C=CC(=C1)C(=O)OC)O
InChI	InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3
InChI Key	BVWTXUYLKBHMOX-UHFFFAOYSA-N
Boiling Point	285-287 °C(lit.)
Melting Point	64-67 °C(lit.)
Flash Point	285-287 °C
Purity	99%
Density	1.2481 g/cm³
Solubility	Soluble in chloroform, methanol
Appearance	Powder and granules
Storage	Sealed in dry, room temperature
Exact Mass	182.05790880
Monoisotopic Mass	182.05790880
Physical State	Powder
Refractive Index	1.4500
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	55.8 Ų