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185836-34-4

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Basic Information
CAS No.: 185836-34-4
Name: (R)-(+)-4-(METHOXYMETHYL)-1,3-DIOXOLAN-2-ONE
Molecular Structure:
Molecular Structure of 185836-34-4 ((R)-(+)-4-(METHOXYMETHYL)-1,3-DIOXOLAN-2-ONE)
Formula: C5H8O4
Molecular Weight: 132.1146
Synonyms: (R)-3-Methoxy-1,2-propanediol cyclic carbonate;
Density: 1.187 g/cm3
Boiling Point: 257.4 °C at 760 mmHg
Flash Point: 112.7 °C
Solubility: Soluble in water
PSA: 44.76000
LogP: 0.16820
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Specification

The 1,3-Dioxolan-2-one,4-(methoxymethyl)-, (4R)-, with the CAS registry number 185836-34-4, is also known as (R)-3-Methoxy-1,2-propanediol cyclic carbonate. It belongs to the product categories of Carbonates; Dioxanes & Dioxolanes; Dioxolanes. This chemical's molecular formula is C5H8O4 and molecular weight is 132.1146. What's more, its systematic name is (4R)-4-(Methoxymethyl)-1,3-dioxolan-2-one.

Physical properties about 1,3-Dioxolan-2-one,4-(methoxymethyl)-, (4R)- are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 6.8; (5)ACD/KOC (pH 7.4): 6.8; (6)#H bond acceptors: 4; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 44.76 Å2; (10)Index of Refraction: 1.421; (11)Molar Refractivity: 28.24 cm3; (12)Molar Volume: 111.2 cm3; (13)Polarizability: 11.19×10-24 cm3; (14)Surface Tension: 32 dyne/cm; (15)Density: 1.187 g/cm3; (16)Flash Point: 112.7 °C; (17)Enthalpy of Vaporization: 49.5 kJ/mol; (18)Boiling Point: 257.4 °C at 760 mmHg; (19)Vapour Pressure: 0.0145 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: COC[C@@H]1COC(=O)O1
(2) InChI: InChI=1/C5H8O4/c1-7-2-4-3-8-5(6)9-4/h4H,2-3H2,1H3/t4-/m1/s1
(3) InChIKey: DNSGQMOSYDHNHO-SCSAIBSYBD