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Org 27569

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Name

Org 27569

EINECS 278-169-7
CAS No. 868273-06-7 Density 1.218
PSA 48.13000 LogP 5.80240
Solubility N/A Melting Point N/A
Formula C24H28 Cl N3 O Boiling Point 660.3 ºC at 760 mmHg
Molecular Weight 409.959 Flash Point 353.2 ºC
Transport Information N/A Appearance N/A
Safety
Hazard Codes Xn
Risk Statements 22
Risk Codes 22
Molecular Structure Molecular Structure of 868273-06-7 (5-chloro-3-ethyl-1H-indole-2-carboxylic  acid  [2-(4-piperidin-1-yl-phenyl)-ethyl]-amide) Hazard Symbols
Synonyms

Org 27569;

Article Data 2

Org 27569 Specification

1H-Indole-2-carboxamide,5-chloro-3-ethyl-N-[2-[4-(1-piperidinyl)phenyl]ethyl]-, with its cas registry number 868273-06-7, has its systematic name of 5-chloro-3-ethyl-N-[2-[4-(1-piperidyl)phenyl]ethyl]-1H-indole-2-carboxamide. 

The physical properties of this chemical are as follows: (1)ACD/LogP: 6.36; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.88; (4)ACD/LogD (pH 7.4): 6.35; (5)#H bond acceptors: 4; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 48.13; (9)Index of Refraction: 1.635; (10)Molar Refractivity: 120.53 cm3; (11)Molar Volume: 336.4 cm3; (12)Polarizability: 47.78 ×10-24 cm3; (13)Surface Tension: 53 dyne/cm; (14)Density: 1.218 g/cm3; (15)Flash Point: 353.2 °C; (16)Enthalpy of Vaporization: 97.17 kJ/mol; (17)Boiling Point: 660.3 °C at 760 mmHg; (18)Vapour Pressure: 2.61E-17 mmHg at 25°C. 

When you are dealing with this chemical, please be cautious. Being a kind of harmful chemical, it may may cause damage to health. And if swallowed, it will be very dangerous. Therefore, you should wear suitable protective clothing and eye/face protection, and if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 

In addition, you could convert the following datas into the molecular structure:
(1)SMILES:CCc1c2cc(ccc2[nH]c1C(=O)NCCc3ccc(cc3)N4CCCCC4)Cl
(2)InChI:InChI=1/C24H28ClN3O/c1-2-20-21-16-18(25)8-11-22(21)27-23(20)24(29)26-13-12-17-6-9-19(10-7-17)28-14-4-3-5-15-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)
(3)InChIKey:AHFZDNYNXFMRFQ-UHFFFAOYAV

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