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2,5-Furandione,3-(acetyloxy)dihydro-, (3R)- (79814-40-7)

Identification
Name:2,5-Furandione,3-(acetyloxy)dihydro-, (3R)-
Synonyms:2,5-Furandione,3-(acetyloxy)dihydro-, (R)-;(R)-3-Acetoxy-3,4-dihydro-2,5-furandione;
CAS:79814-40-7
Molecular Formula: C6H6 O5
Molecular Weight: 158.11
InChI: InChI=1/C6H6O5/c1-3(7)10-4-2-5(8)11-6(4)9/h4H,2H2,1H3/t4-/m1/s1
Molecular Structure: (C6H6O5) 2,5-Furandione,3-(acetyloxy)dihydro-, (R)-;(R)-3-Acetoxy-3,4-dihydro-2,5-furandione;
Properties
Density:1.386g/cm3
Refractive index:1.466
Alpha:27 º (C=1 IN CHLOROFORM)
Specification:

 

The (R)-(+)-2-Acetoxysuccinic anhydride with cas registry number 79814-40-7, is also named (+)-o-acetyl-d-malic anhydride ; o-acetyl d-malic anhydride .The (R)-(+)-2-Acetoxysuccinic anhydride belongs to the following product categories:(1)Chiral Compound; (2)Chiral Reagents; (3)Heterocycles; (4)Miscellaneous Reagents.

Physical properties of (R)-(+)-2-Acetoxysuccinic anhydride  :(1)ACD/LogP: -1.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5; (8)ACD/KOC (pH 7.4): 5; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 69.67 ?2 ; (13)Index of Refraction: 1.466; (14)Molar Refractivity: 31.586 cm3; (15)Molar Volume: 114.06 cm3; (16)Polarizability: 12.522×10-24cm3; (17)Surface Tension: 44.646 dyne/cm; (18)Enthalpy of Vaporization: 53.638 kJ/mol; (19)Vapour Pressure: 0.001 mmHg at 25°C .

When you are using this chemical, please be cautious about it as the following:
The (R)-(+)-2-Acetoxysuccinic anhydride irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:(1)SMILES:O=C(O[C@H]1C(=O)OC(=O)C1)C; (2)InChI:InChI=1/C6H6O5/c1-3(7)10-4-2-5(8)11-6(4)9/h4H,2H2,1H3/t4-/m1/s1; (3)InChIKey:SSWJHSASZZAIAU-SCSAIBSYBD; (4)Std. InChI:InChI=1S/C6H6O5/c1-3(7)10-4-2-5(8)11-6(4)9/h4H,2H2,1H3/t4-/m1/s1; (5)Std. InChIKey:SSWJHSASZZAIAU-SCSAIBSYSA-N.

Sensitive: Moisture Sensitive
Usage:Used as intermediates for detergents via O-acetylmalic acid amides. Regioselective ring opening of malic acid anhydrides by carbon nucleophiles
Safety Data
Hazard Symbols Xi:Irritant