CAS No.127986-84-9,(S)-(-)-ALPHA,ALPHA-DI(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL Suppliers,MSDS download

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Molecular Structure:
CAS No.:	127986-84-9
Name:	(S)-(-)-ALPHA,ALPHA-DI(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL
Article Data:	2

Formula:	C₂₅H₂₃NO
Molecular Weight:	353.464
Synonyms:	2-Pyrrolidinemethanol,a,a-di-2-naphthalenyl-, (S)-;(S)-(-)-Di-(2-naphthyl)-2-pyrrolidinemethanol;
Density:	1.207g/cm³
Melting Point:	135-138 °C(lit.)
Boiling Point:	528.2 °C at 760 mmHg
Flash Point:	129.2 °C
Appearance:	white to light yellow crystal powder
Hazard Symbols:	Xn,Xi
Risk Codes:	36/37/38-22
Safety:	26-36
PSA:	32.26000
LogP:	5.30970

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Specification

The (S)-(-)-Di-(2-naphthyl)-2-pyrrolidinemethanol with the CAS number 127986-84-9 is also called 2-Pyrrolidinemethanol, a,a-di-2-naphthalenyl-, (2S)-. The systematic name is dinaphthalen-2-yl[(2S)-pyrrolidin-2-yl]methanol. Its molecular formula is C₂₅H₂₃NO. This chemical belongs to the following product categories: (1)Chiral; (2)Chiral Reagen; (3)Peptide. It is white to light yellow crystal powder.

The properties of the (S)-(-)-Di-(2-naphthyl)-2-pyrrolidinemethanol are: (1)ACD/LogP: 5.37; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.28; (4)ACD/LogD (pH 7.4): 2.69; (5)ACD/BCF (pH 5.5): 5.75; (6)ACD/BCF (pH 7.4): 14.79; (7)ACD/KOC (pH 5.5): 16.11; (8)ACD/KOC (pH 7.4): 41.39; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.692; (14)Molar Refractivity: 112.15 cm³; (15)Molar Volume: 292.7 cm³; (16)Polarizability: 44.46×10^-24cm³; (17)Surface Tension: 54.2 dyne/cm; (18)Enthalpy of Vaporization: 84.52 kJ/mol; (19)Vapour Pressure: 5.5×10^-12 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is harmful if swallowed. It is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(c1ccc2c(c1)cccc2)(c4cc3ccccc3cc4)[C@H]5NCCC5
(2)InChI: InChI=1/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1
(3)InChIKey: LNUDNNFEXRHHGY-DEOSSOPVBN