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CAS No.: | 40172-06-3 |
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Name: | 2-(3,4-DICHLORO-BENZYLAMINO)-ETHANOL |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C9H11Cl2NO |
Molecular Weight: | 220.098 |
Synonyms: | Ethanol,2-(3,4-dichlorobenzylamino)- (6CI);2-(3,4-Dichlorbenzylamino)ethanol;2-(3,4-Dichlorobenzylamino)ethanol;N-(3,4-Dichlorobenzyl)ethanolamine;NSC91875; |
Density: | 1.302 g/cm3 |
Boiling Point: | 349.7 °C at 760 mmHg |
Flash Point: | 165.3 °C |
PSA: | 32.26000 |
LogP: | 2.46620 |
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The CAS registry number of Ethanol,2-[[(3,4-dichlorophenyl)methyl]amino]- is 40172-06-3. This chemical is also named as NSC91875. In addition, its molecular formula is C9H11Cl2NO and molecular weight is 220.1. Its systematic name and IUPAC name are the same which is called 2-[(3,4-dichlorobenzyl)amino]ethanol.
Physical properties about Ethanol,2-[[(3,4-dichlorophenyl)methyl]amino]- are: (1)ACD/LogP: 2.19; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.568; (6)Molar Refractivity: 55.35 cm3; (7)Molar Volume: 168.9 cm3; (8)Surface Tension: 46 dyne/cm; (9)Density: 1.302 g/cm3; (10)Flash Point: 165.3 °C; (11)Enthalpy of Vaporization: 62.7 kJ/mol; (12)Boiling Point: 349.7 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1Cl)CNCCO
(2)InChI: InChI=1/C9H11Cl2NO/c10-8-2-1-7(5-9(8)11)6-12-3-4-13/h1-2,5,12-13H,3-4,6H2
(3)InChIKey: VIYIYSBQARQLCC-UHFFFAOYAV