Isovanillin

Catalog	ACM621590
CAS	621-59-0
Structure
Synonyms	2-Methoxy-5-formylphenol
IUPAC Name	3-Hydroxy-4-methoxybenzaldehyde
Molecular Weight	152.15
Molecular Formula	C8H8O3
Canonical SMILES	COC1=C(C=C(C=C1)C=O)O
InChI	InChI=1S/C8H8O3/c1-11-8-3-2-6(5-9)4-7(8)10/h2-5,10H,1H3
InChI Key	JVTZFYYHCGSXJV-UHFFFAOYSA-N
Boiling Point	179 °C/15 mmHg(lit.)
Melting Point	113-116 °C
Flash Point	179 °C
Purity	98%
Density	1.20 g/cm³
Solubility	Soluble in acetone, methanol
Appearance	Faintly brown crystalline
Storage	Keep in dark place, sealed in dry, room temperature
Exact Mass	152.047344113
Monoisotopic Mass	152.047344113
Physical State	Crystalline
Refractive Index	1.4945
Storage Conditions	Dark and dry place,Room Temperature
Topological Polar Surface Area	46.5 Ų