Ethanol,2-[[(1S)-1-phenylethyl]amino]- supplier

Name
(S)-(-)-N-(2-HYDROXYETHYL)-ALPHA-PHENYLETHYLAMINE
EINECS
CAS No. 66849-29-4
Article Data6
CAS DataBase
Density 1.017 g/cm³
Solubility
Melting Point 76°C
Formula C₁₀H₁₅NO
Boiling Point 285.7 °C at 760 mmHg
Molecular Weight 165.235
Flash Point 114.4 °C
Transport Information
Appearance clear colorless liquid
Safety 37/39-26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Ethanol,2-[(1-phenylethyl)amino]-, (S)-;
PSA 32.26000
LogP 1.72040

Ethanol,2-[[(1S)-1-phenylethyl]amino]- Specification

The CAS registry number of Ethanol,2-[[(1S)-1-phenylethyl]amino]- is 66849-29-4. This chemical is also named as 2-{[(1S)-1-Phenylethyl]amino}ethanol. In addition, its molecular formula is C₁₀H₁₅NO and molecular weight is 165.23. Its IUPAC name is called 2-hydroxyethyl-[(1S)-1-phenylethyl]azanium.

Physical properties about Ethanol,2-[[(1S)-1-phenylethyl]amino]- are: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.43; (4)ACD/LogD (pH 7.4): 0.05; (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): 5.66; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Index of Refraction: 1.53; (13)Molar Refractivity: 50.2 cm³; (14)Molar Volume: 162.3 cm³; (15)Surface Tension: 39.4 dyne/cm; (16)Density: 1.017 g/cm³; (17)Flash Point: 114.4 °C; (18)Enthalpy of Vaporization: 55.43 kJ/mol; (19)Boiling Point: 285.7 °C at 760 mmHg; (20)Vapour Pressure: 0.00129 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is toxic if swallowed. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible). Whenever you will contact it, please wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: OCCN[C@H](c1ccccc1)C
(2)InChI: InChI=1/C10H15NO/c1-9(11-7-8-12)10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3/t9-/m0/s1
(3)InChIKey: GXIWMXAAPLZOBY-VIFPVBQEBV

Product Name

(S)-(-)-N-(2-HYDROXYETHYL)-ALPHA-PHENYLETHYLAMINE

Ethanol,2-[[(1S)-1-phenylethyl]amino]- Specification

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