The (S)-(-)-N-Benzyl-1-phenylethylamine is an organic compound with the formula C15H17N. The IUPAC name of this chemical is cyclohexylmethyl-[(1S)-1-phenylethyl]azanium. With the CAS registry number 17480-69-2, it is also named as (1R)-N-Benzyl-1-phenylethanamin. The product's categories are Chiral; Asymmetric Synthesis; Synthetic Organic Chemistry. Besides, it is a colorless to light yellow liquid, which should be stored in a closed and dark place. It is used as organic intermediate.
Physical properties about (S)-(-)-N-Benzyl-1-phenylethylamine are: (1)ACD/LogP: 3.77; (2)ACD/LogD (pH 5.5): 0.89; (3)ACD/LogD (pH 7.4): 2.37; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 17.33; (6)ACD/KOC (pH 5.5): 3.5; (7)ACD/KOC (pH 7.4): 107.61; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.569; (13)Molar Refractivity: 68.52 cm3; (14)Molar Volume: 209 cm3; (15)Polarizability: 27.16×10-24cm3; (16)Surface Tension: 39 dyne/cm; (17)Density: 1.01 g/cm3; (18)Flash Point: 140.6 °C; (19)Enthalpy of Vaporization: 55.01 kJ/mol; (20)Boiling Point: 309.3 °C at 760 mmHg; (21)Vapour Pressure: 0.000643 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of 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: N([C@@H](c1ccccc1)C)Cc2ccccc2
(2)InChI: InChI=1/C15H17N/c1-13(15-10-6-3-7-11-15)16-12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3/t13-/m1/s1
(3)InChIKey: ZYZHMSJNPCYUTB-CYBMUJFWBH
(4)Std. InChI: InChI=1S/C15H17N/c1-13(15-10-6-3-7-11-15)16-12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3/t13-/m1/s1
(5)Std. InChIKey: ZYZHMSJNPCYUTB-CYBMUJFWSA-N
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