(R)-Prunasin

About This Item

Molecular Formula	C₁₄H₁₇NO₆
CAS Number	99-18-3

FC-0900544

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Properties

Chemical Identifiers

IUPAC Name	(2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile
SMILES	C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
InChI Key	ZKSZEJFBGODIJW-GMDXDWKASA-N
InChI	InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9-,10+,11+,12-,13+,14+/m0/s1

Physical Properties

Boiling Point	527.0±50.0 °C at 760 mmHg
Melting Point	147 - 148 °C
Flash Point	272.5±30.1 °C
Density	1.5±0.1 g/cm3

Safety Information

Hazard Class

Danger

Flash Point

272.5±30.1 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.