Aza-15-crown-5 CAS NO.66943-05-3

The Aza-15-crown-5, with CAS registry number 66943-05-3, belongs to the following product categories: (1)Azacrown Ethers; (2)Crown Ethers; (3)Macrocycles for Host-Guest Chemistry; (4)Functional Materials. It has the systematic name of 1,4,7,10-tetraoxa-13-azacyclopentadecane. This chemical is a kind of light brown crystalline mass. It should be stored at the temperature of 0-6°C. And the chemical formula of this chemical is C₁₀H₂₁NO₄. What's more, its EINECS is 266-523-3.

Physical properties of Aza-15-crown-5: (1)ACD/LogP: -1.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.33; (4)ACD/LogD (pH 7.4): -2.8; (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: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 40.16 Å²; (13)Index of Refraction: 1.408; (14)Molar Refractivity: 55.88 cm³; (15)Molar Volume: 226.3 cm³; (16)Polarizability: 22.15×10^-24cm³; (17)Surface Tension: 30.4 dyne/cm; (18)Density: 0.968 g/cm³; (19)Flash Point: 140.5 °C; (20)Enthalpy of Vaporization: 59.12 kJ/mol; (21)Boiling Point: 347 °C at 760 mmHg; (22)Vapour Pressure: 5.54E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by 13-(toluene-4-sulfonyl)-1,4,7,10-tetraoxa-13-aza-cyclopentadecane. This reaction will need reagent LiAlH₄. The yield is about 83%.

When you are using this chemical, please be cautious about it as the following:
The Aza-15-crown-5 irritates to eyes, respiratory system and skin. And it is harmful by inhalation and if swallowed. 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: O1CCNCCOCCOCCOCC1
(2)InChI: InChI=1/C10H21NO4/c1-3-12-5-7-14-9-10-15-

The Aza-15-crown-5, with CAS registry number 66943-05-3, belongs to the following product categories: (1)Azacrown Ethers; (2)Crown Ethers; (3)Macrocycles for Host-Guest Chemistry; (4)Functional Materials. It has the systematic name of 1,4,7,10-tetraoxa-13-azacyclopentadecane. This chemical is a kind of light brown crystalline mass. It should be stored at the temperature of 0-6°C. And the chemical formula of this chemical is C₁₀H₂₁NO₄. What's more, its EINECS is 266-523-3.

Physical properties of Aza-15-crown-5: (1)ACD/LogP: -1.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.33; (4)ACD/LogD (pH 7.4): -2.8; (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: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 40.16 Å²; (13)Index of Refraction: 1.408; (14)Molar Refractivity: 55.88 cm³; (15)Molar Volume: 226.3 cm³; (16)Polarizability: 22.15×10^-24cm³; (17)Surface Tension: 30.4 dyne/cm; (18)Density: 0.968 g/cm³; (19)Flash Point: 140.5 °C; (20)Enthalpy of Vaporization: 59.12 kJ/mol; (21)Boiling Point: 347 °C at 760 mmHg; (22)Vapour Pressure: 5.54E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by 13-(toluene-4-sulfonyl)-1,4,7,10-tetraoxa-13-aza-cyclopentadecane. This reaction will need reagent LiAlH₄. The yield is about 83%.

When you are using this chemical, please be cautious about it as the following:
The Aza-15-crown-5 irritates to eyes, respiratory system and skin. And it is harmful by inhalation and if swallowed. 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: O1CCNCCOCCOCCOCC1
(2)InChI: InChI=1/C10H21NO4/c1-3-12-5-7-14-9-10-15-