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Glutaric acid monomethyl ester

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Name

Glutaric acid monomethyl ester

EINECS 216-116-1
CAS No. 1501-27-5 Density 1.162 g/cm3
PSA 63.60000 LogP 0.41430
Solubility Slightly soluble in water. Melting Point N/A
Formula C6H10O4 Boiling Point 277.3 °C at 760 mmHg
Molecular Weight 146.143 Flash Point 110.5 °C
Transport Information N/A Appearance White or almost white crystalline powder
Safety 23-24/25 Risk Codes 36/38
Molecular Structure Molecular Structure of 1501-27-5 (Glutaric acid monomethyl ester) Hazard Symbols R36/38:Irritating to eyes and skin.;
Synonyms

Methyl hydrogen glutarate;5-methoxy-5-oxopentanoic acid;

Article Data 46

Glutaric acid monomethyl ester Specification

The CAS register number of Glutaric acid monomethyl ester is 1501-27-5. It also can be called as Methyl hydrogen glutarate and the IUPAC name about this chemical is 5-methoxy-5-oxopentanoic acid. The molecular formula about this chemical is C6H10O4 and the molecular weight is 146.14. It belongs to the Acids & Esters. This chemical is irritating to eyes and skin. When you are using it, please do not breathe vapour and avoid contact with skin and eyes.
 
Physical properties about Glutaric acid monomethyl ester are: (1)ACD/LogP: 0.20; (2)ACD/LogD (pH 5.5): -0.74; (3)ACD/LogD (pH 7.4): -2.54; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.55; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 52.6Å2; (12)Index of Refraction: 1.44; (13)Molar Refractivity: 33.18 cm3; (14)Molar Volume: 125.6 cm3; (15)Polarizability: 13.15x10-24cm3; (16)Surface Tension: 40.6 dyne/cm; (17)Enthalpy of Vaporization: 56.77 kJ/mol; (18)Boiling Point: 277.3 °C at 760 mmHg; (19)Vapour Pressure: 0.00123 mmHg at 25°C.

Preparation: this chemical can be prepared by acrylic acid methyl ester and iodoacetic acid at ambient temperature. This reaction will need reagentsodium borohydride, a,a'-azobisisobutyronitrile, tributyltin chloride and solvent ethanol. The reaction time is 7 hour(s). The yield is about 60%.

Uses of Glutaric acid monomethyl ester: it can be used to produce pentanedioic acid at ambient temperature. This reaction will need reagent 15percent aq. sodium hydroξde and solvent methanol with reaction time of 3 hours. The yield is about 54%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CCCC(=O)OC
(2)InChI: InChI=1/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)
(3)InChIKey: IBMRTYCHDPMBFN-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)
(5)Std. InChIKey: IBMRTYCHDPMBFN-UHFFFAOYSA-N

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