CAS No.76326-31-3,DL-2-Amino-5-phosphonopentanoic acid Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	76326-31-3
Name:	DL-2-Amino-5-phosphonopentanoic acid
Article Data:	9

Formula:	C₅H₁₂NO₅P
Molecular Weight:	197.128
Synonyms:	DL-Norvaline,5-phosphono-;2-Amino-5-phosphonopentanoic acid;2-Amino-5-phosphonovalericacid;5-Phosphono-DL-norvaline;AP 5 (amino acid);DL-2-Amino-5-phosphonovaleric acid;
Density:	1.529 g/cm³
Boiling Point:	482.1 °C at 760 mmHg
Flash Point:	245.4 °C
Solubility:	NH₄OH 1 M: 50 mg/mL, clear, colorless
Appearance:	white solid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	130.66000
LogP:	0.05650

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Specification

The DL-2-Amino-5-phosphonopentanoic acid, with the CAS registry number 76326-31-3, is also known as 2-Amino-5-phosphovaleric acid. It belongs to the product categories of Glutamate Receptor; Glutamate. This chemical's molecular formula is C₅H₁₂NO₅P and molecular weight is 197.13. What's more, its IUPAC name is 2-amino-5-phosphonopentanoic acid. It should be sealed and stored in a cool and dry place. What's more, it should be protected from oxides and moisture.

Physical properties of DL-2-Amino-5-phosphonopentanoic acid are: (1)ACD/LogP: -2.32; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -5.81; (4)ACD/LogD (pH 7.4): -5.91; (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: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 74.88 Å²; (13)Index of Refraction: 1.536; (14)Molar Refractivity: 40.21 cm³; (15)Molar Volume: 128.9 cm³; (16)Polarizability: 15.94×10^-24cm³; (17)Surface Tension: 79.4 dyne/cm; (18)Density: 1.529 g/cm³; (19)Flash Point: 245.4 °C; (20)Enthalpy of Vaporization: 81.81 kJ/mol; (21)Boiling Point: 482.1 °C at 760 mmHg; (22)Vapour Pressure: 1.28E-10 mmHg at 25°C.

Preparation: this chemical can be prepared by 3-benzyl-2-methylimino-thiazolidin-5-one by heating. This reaction will need reagent NaOH with the reaction time of 15 hours. The yield is about 92%.

Uses of DL-2-Amino-5-phosphonopentanoic acid: it can be used to produce 2-phenylacetylamino-5-phosphono-pentanoic acid at the temperature of 0 - 5 °C. It will need solvents dioxane, H₂O. The yield is about 69%.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(CC(C(=O)O)N)CP(=O)(O)O
(2)InChI: InChI=1S/C5H12NO5P/c6-4(5(7)8)2-1-3-12(9,10)11/h4H,1-3,6H2,(H,7,8)(H2,9,10,11)
(3)InChIKey: VOROEQBFPPIACJ-UHFFFAOYSA-N