2,5-Pyrrolidinedicarboxylic acid supplier

Name
2,5-Pyrrolidinedicarboxylicacid(6CI,7CI,9CI)
EINECS
CAS No. 72000-65-8
Article Data2
CAS DataBase
Density 1.456 g/cm³
Solubility
Melting Point
Formula C₆H₉NO₄
Boiling Point 420.3 °C at 760 mmHg
Molecular Weight 159.142
Flash Point 208 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,5-Pyrrolidinedicarboxylicacid(6CI,7CI,9CI);2,5-Pyrrolidinedicarboxylic acid;
PSA 86.63000
LogP -0.39500

2,5-Pyrrolidinedicarboxylic acid Specification

The 2,5-Pyrrolidinedicarboxylic acid with cas registry number of 72000-65-8, belongs to the following product categories: (1)pyrrole; (2)chiral reagents. Its systematic name is pyrrolidine-2,5-dicarboxylic acid. And it is also named Pyrrolidine-2,5-dicarboxylic acid; 2,5-Pyrrolidinedicarboxylicacid(6CI,7CI,9CI).

Physical properties about this chemical are: (1)ACD/LogP: -1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 55.84 Å²; (11)Index of Refraction: 1.534; (12)Molar Refractivity: 34 cm³; (13)Molar Volume: 109.2 cm³; (14)Polarizability: 13.48×10^-24cm³; (15)Surface Tension: 64.1 dyne/cm; (16)Enthalpy of Vaporization: 73.95 kJ/mol; (17)Vapour Pressure: 3.05E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O=C(O)C1NC(C(=O)O)CC1;
(2)InChI:InChI=1/C6H9NO4/c8-5(9)3-1-2-4(7-3)6(10)11/h3-4,7H,1-2H2,(H,8,9)(H,10,11);
(3)InChIKey:ZKXSPYPKBXRBNP-UHFFFAOYAB;
(4)Std. InChI:InChI=1S/C6H9NO4/c8-5(9)3-1-2-4(7-3)6(10)11/h3-4,7H,1-2H2,(H,8,9)(H,10,11);
(5)Std. InChIKey:ZKXSPYPKBXRBNP-UHFFFAOYSA-N.

Product Name

2,5-Pyrrolidinedicarboxylicacid(6CI,7CI,9CI)

2,5-Pyrrolidinedicarboxylic acid Specification

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