CAS No.54594-06-8,D-Allylglycine Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	54594-06-8
Name:	D-Allylglycine
Article Data:	38

Formula:	C₅H₉NO₂
Molecular Weight:	115.132
Synonyms:	4-Pentenoicacid, 2-amino-, (R)-;(+)-Allylglycine;(2R)-2-Amino-4-pentenoic acid;(R)-2-Amino-4-pentenoic acid;(R)-Allylglycine;D-2-Amino-4-pentenoic acid;D-Allylglycine;D-a-Allylglycine;
EINECS:	231-689-8
Density:	1.098 g/cm³
Melting Point:	239.3-241.2 °C
Boiling Point:	231 °C at 760 mmHg
Flash Point:	93.5 °C
Appearance:	off-white solid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	22-24/25-36-26
PSA:	49.33000
LogP:	0.23750

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Specification

The 4-Pentenoic acid,2-amino-, (2R)-, with the CAS registry number 54594-06-8, is also known as D-2-Amino-4-pentenoic acid. It belongs to the product categories of Amino Acids; Amino Acid Derivatives; Chiral Reagent; API; Amino Acids 13C, 2H, 15N; Amino Acids & Derivatives; A-Amino. This chemical's molecular formula is C₅H₉NO₂ and molecular weight is 115.13. Its IUPAC name is called (2R)-2-aminopent-4-enoic acid. This chemical can be used for the preparation of enantiomerically pure a-tertiary and a-quaternary a-amino acids.

Physical properties of 4-Pentenoic acid,2-amino-, (2R)-: (1)ACD/LogP: 0.26; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.484; (10)Molar Refractivity: 29.99 cm³; (11)Molar Volume: 104.8 cm³; (12)Surface Tension: 42.8 dyne/cm; (13)Density: 1.098 g/cm³; (14)Flash Point: 93.5 °C; (15)Enthalpy of Vaporization: 51.51 kJ/mol; (16)Boiling Point: 231 °C at 760 mmHg; (17)Vapour Pressure: 0.0226 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. 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. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C=CCC(C(=O)O)N
(2)Isomeric SMILES: C=CC[C@H](C(=O)O)N
(3)InChI: InChI=1S/C5H9NO2/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H,7,8)/t4-/m1/s1
(4)InChIKey: WNNNWFKQCKFSDK-SCSAIBSYSA-N