4-Methoxycinnamaldehyde

CAS	24680-50-0 / 1963-36-6
Structure
Synonyms	(2E)-3-(4-Methoxyphenyl)acrylaldehyde
IUPAC Name	(E)-3-(4-Methoxyphenyl)prop-2-enal
Molecular Weight	162.18
Canonical SMILES	COC1=CC=C(C=C1)C=CC=O
InChI	InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3/b3-2+
InChI Key	AXCXHFKZHDEKTP-NSCUHMNNSA-N
Boiling Point	145 °C
Melting Point	55-60 °C
Flash Point	110 °C
Purity	95%+
Density	1.0281 g/mL at 25 °C(lit.)
Solubility	Insoluble in water; soluble in fats
Exact Mass	162.068079557
Isomeric SMILES	COC1=CC=C(C=C1)/C=C/C=O
Monoisotopic Mass	162.068079557
Physical State	Crystalline powder
Refractive Index	n20/D 1.600(lit.)
Storage Conditions	Inert atmosphere,under -20 °C
Topological Polar Surface Area	26.3 Ų