CAS No.64769-66-0,L-TRANS-PYRROLIDINE-2,4-DICARBOXYLIC ACID Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	64769-66-0
Name:	L-TRANS-PYRROLIDINE-2,4-DICARBOXYLIC ACID
Article Data:	6

Formula:	C₆H₉NO₄
Molecular Weight:	159.142
Synonyms:	2,4-Pyrrolidinedicarboxylicacid, (2S-trans)-;L-trans-Pyrrolidine-2,4-dicarboxylic acid;trans-4-Carboxy-L-proline;(2S,4R)-Pyrrolidine-2,4-dicarboxylic acid;
Density:	1.456 g/cm³
Boiling Point:	355.3 °C at 760 mmHg
Flash Point:	168.7 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	86.63000
LogP:	-0.53750

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Specification

The 2,4-Pyrrolidinedicarboxylicacid, (2S,4R)-, with the CAS registry number 64769-66-0, is also known as L-trans-Pyrrolidine-2,4-dicarboxylic acid. It belongs to the product categories of Pyrrole; Glutamate receptor. This chemical's molecular formula is C₆H₉NO₄and molecular weight is 159.14. What's more, its systematic name is (2S,4R)-pyrrolidine-2,4-dicarboxylic acid. It should be sealed and stored in a cool and dry place. What's more, it should be protected from oxides.

Physical properties of 2,4-Pyrrolidinedicarboxylicacid, (2S,4R)- are: (1)ACD/LogP: -1.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.52; (4)ACD/LogD (pH 7.4): -4.61; (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: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 55.84 Å²; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 34 cm³; (15)Molar Volume: 109.2 cm³; (16)Polarizability: 13.48×10^-24cm³; (17)Surface Tension: 64.1 dyne/cm; (18)Density: 1.456 g/cm³; (19)Flash Point: 168.7 °C; (20)Enthalpy of Vaporization: 65.96 kJ/mol; (21)Boiling Point: 355.3 °C at 760 mmHg; (22)Vapour Pressure: 5.28E-06 mmHg at 25°C.

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)SMILES: O=C(O)[C@H]1NC[C@H](C(=O)O)C1
(2)InChI: InChI=1S/C6H9NO4/c8-5(9)3-1-4(6(10)11)7-2-3/h3-4,7H,1-2H2,(H,8,9)(H,10,11)/t3-,4+/m1/s1
(3)InChIKey:; (4)NRSBQSJHFYZIPH-DMTCNVIQSA-N