CAS No.168560-79-0,AIDA Suppliers

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Basic Information

Molecular Structure:
CAS No.:	168560-79-0
Name:	AIDA
Article Data:	5

Formula:	C₁₁H₁₁NO₄
Molecular Weight:	221.213
Synonyms:	1-Aminoindan-1,5-dicarboxylicacid;AIDA;UPF 523;
Density:	1.481 g/cm³
Boiling Point:	470.4 °C at 760 mmHg
Flash Point:	238.3 °C
Appearance:	White to off-white powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	37/39-26
PSA:	100.62000
LogP:	1.26990

Total:13 Page 1 of 1 1

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Specification

The 1H-Indene-1,5-dicarboxylicacid, 1-amino-2,3-dihydro-, with CAS registry number 168560-79-0, belongs to the following product category: Glutamate receptor. It has the systematic name of 1-amino-2,3-dihydro-1H-indene-1,5-dicarboxylic acid. This chemical is a kind of white to off-white powder. It should be stored at the temperature of 0-6°C. Its classification codes are Excitatory Amino Acid Agents, Excitatory Amino Acid Antagonists and Neurotransmitter Agents. And the chemical formula of this chemical is C₁₁H₁₁NO₄.

Physical properties of 1H-Indene-1,5-dicarboxylicacid, 1-amino-2,3-dihydro-: (1)ACD/LogP: 0.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.92; (4)ACD/LogD (pH 7.4): -3.03; (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: 3; (12)Polar Surface Area: 55.84 Å²; (13)Index of Refraction: 1.657; (14)Molar Refractivity: 54.92 cm³; (15)Molar Volume: 149.3 cm³; (16)Polarizability: 21.77×10^-24cm³; (17)Surface Tension: 76.2 dyne/cm; (18)Density: 1.481 g/cm³; (19)Flash Point: 238.3 °C; (20)Enthalpy of Vaporization: 77.21 kJ/mol; (21)Boiling Point: 470.4 °C at 760 mmHg; (22)Vapour Pressure: 1.19E-09 mmHg at 25°C.

Preparation: this chemical can be prepared by C₁₃H₁₂N₂O₄. This reaction will need reagent Ba(OH)₂^.8H₂O. The reaction time is 3 hour(s) with reaction temperature of 120 ℃. The yield is about 43%.

1H-Indene-1,5-dicarboxylicacid, 1-amino-2,3-dihydro- can be prepared by C13H12N2O4.

When you are using this chemical, please be cautious about it as the following:
The 1H-Indene-1,5-dicarboxylicacid, 1-amino-2,3-dihydro- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccc2c(c1)CCC2(N)C(=O)O
(2)InChI: InChI=1/C11H11NO4/c12-11(10(15)16)4-3-6-5-7(9(13)14)1-2-8(6)11/h1-2,5H,3-4,12H2,(H,13,14)(H,15,16)
(3)InChIKey: LSTPKMWNRWCNLS-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C11H11NO4/c12-11(10(15)16)4-3-6-5-7(9(13)14)1-2-8(6)11/h1-2,5H,3-4,12H2,(H,13,14)(H,15,16)
(5)Std. InChIKey: LSTPKMWNRWCNLS-UHFFFAOYSA-N