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| CAS No.: | 7150-74-5 |
|---|---|
| Name: | GAMMA-METHYLENE-DL-GLUTAMIC ACID |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C6H9NO4 |
| Molecular Weight: | 159.142 |
| Synonyms: | 4-Methylideneglutamic acid;DL-4-Methyleneglutamic acid; |
| Density: | 1.374 g/cm3 |
| Boiling Point: | 417.6 °C at 760 mmHg |
| Flash Point: | 206.4 °C |
| PSA: | 100.62000 |
| LogP: | 0.12950 |
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- Total:7 Page 1 of 1 1
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Specification
The Glutamic acid, 4-methylene-, with the CAS registry number 7150-74-5, is also known as 4-Methylideneglutamic acid. This chemical's molecular formula is C6H9NO4 and molecular weight is 159.14. What's more, its IUPAC name is 2-Amino-4-methylidenepentanedioic acid. Besides, it can be stored at room temperature.
Physical properties about Glutamic acid, 4-methylene- are: (1)ACD/LogP: 0.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.04; (4)ACD/LogD (pH 7.4): -3.19; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.84 Å2; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 36.03 cm3; (15)Molar Volume: 115.7 cm3; (16)Polarizability: 14.28×10-24 cm3; (17)Surface Tension: 62.9 dyne/cm; (18)Density: 1.374 g/cm3; (19)Flash Point: 206.4 °C; (20)Enthalpy of Vaporization: 73.61 kJ/mol; (21)Boiling Point: 417.6 °C at 760 mmHg; (22)Vapour Pressure: 3.82E-08 mmHg at 25 °C.
Preparation of Glutamic acid, 4-methylene-: this chemical is prepared by 2-Benzoylamino-4-methylene-pentanedioic acid 5-ethyl ester 1-methyl ester by heating. The reaction needs reagent HCl and solvent Dioxane. The reaction time is 24 hours. The yield is about 52 %.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)\C(=C)CC(N)C(=O)O
(2) InChI: InChI=1/C6H9NO4/c1-3(5(8)9)2-4(7)6(10)11/h4H,1-2,7H2,(H,8,9)(H,10,11)
(3) InChIKey: RCCMXKJGURLWPB-UHFFFAOYAI