5-Hydroxymethylfurfural

Catalog	ACM67470-2
CAS	67-47-0
Structure
Description	5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors.
Synonyms	5-Hydroxymethyl-2-fluraldehyde
IUPAC Name	5-(Hydroxymethyl)furan-2-carbaldehyde
Molecular Weight	126.11
Molecular Formula	C6H6O3
Canonical SMILES	C1=C(OC(=C1)C=O)CO
InChI	InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChI Key	NOEGNKMFWQHSLB-UHFFFAOYSA-N
Boiling Point	114-116 °C /1mmHg
Melting Point	28-34 °C
Flash Point	175 °F
Purity	99%
Density	1.243 g/ml
Solubility	Soluble in water, alcohol, ethyl acetate, acetone, dimethylformamide, benzene, ether and chloroform
Appearance	<30°C Solid,>34°C Liquid
Storage	Pure form-20°C, 3 years; In solvent-80°C, 6 months; -20°C, 1 month.
Exact Mass	126.031694049
Monoisotopic Mass	126.031694049
Physical State	Liquid or crystalline powder
Refractive Index	n20/D 1.562(lit.)
Storage Conditions	2-8 °C
Topological Polar Surface Area	50.4 Ų