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2(5H)-Furanone,5-(hydroxymethyl)-, (5S)- (78508-96-0)

Identification
Name:2(5H)-Furanone,5-(hydroxymethyl)-, (5S)-
Synonyms:2(5H)-Furanone,5-(hydroxymethyl)-, (S)-;(5S)-Hydroxymethyl-5H-furan-2-one;(S)-(-)-5-(Hydroxymethyl)-2(5H)furanone;(S)-5-(Hydroxymethyl)furan-2(5H)-one;(S)-5-Hydroxy-2-penten-4-olide;l-Ranunculin aglycon;
CAS:78508-96-0
Molecular Formula: C5H6O3
Molecular Weight: 114.0993
InChI: InChI=1S/C5H6O3/c6-3-4-1-2-5(7)8-4/h1-2,4,6H,3H2
Molecular Structure: (C5H6O3) 2(5H)-Furanone,5-(hydroxymethyl)-, (S)-;(5S)-Hydroxymethyl-5H-furan-2-one;(S)-(-)-5-(Hydroxymethyl)-...
Properties
Melting Point: 41-43ºC(lit.)
Flash Point: 113 ºC
Boiling Point: 334.8 ºC at 760 mmHg
Density:1.294 g/cm3
Refractive index:1.502
Specification:

The (S)-(-)-5-Hydroxymethyl-2(5H)-furanone, with the CAS registry number 78508-96-0, has the systematic name of (5S)-5-(hydroxymethyl)furan-2(5H)-one. It belongs to the following product categories: Chiral Reagent; Chiral Building Blocks; Furans; Heterocyclic Building Blocks. And the molecular formula of the chemical is C5H6O3. What's more, while dealing with this chemical, you should avoid contact with skin and eyes.

The characteristics of (S)-(-)-5-Hydroxymethyl-2(5H)-furanone are as followings: (1)ACD/LogP: -1.92; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 46.53 Å2; (7)Index of Refraction: 1.502; (8)Molar Refractivity: 26.015 cm3; (9)Molar Volume: 88.121 cm3; (10)Polarizability: 10.313×10-24cm3; (11)Surface Tension: 45.369 dyne/cm; (12)Density: 1.295 g/cm3; (13)Flash Point: 166.808 °C; (14)Enthalpy of Vaporization: 66.937 kJ/mol; (15)Boiling Point: 334.754 °C at 760 mmHg; (16)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C\1O[C@@H](/C=C/1)CO
(2)InChI: InChI=1/C5H6O3/c6-3-4-1-2-5(7)8-4/h1-2,4,6H,3H2/t4-/m0/s1
(3)InChIKey: AWNLUIGMHSSXHB-BYPYZUCNBO

Flash Point: 113 ºC
Storage Temperature: 2-8°C
Safety Data