alpha,alpha-Diphenyl-N-methyl-L-prolinol supplier

Name
(S)-(+)-2-[HYDROXY(DIPHENYL)METHYL]-1-METHYLPYRROLIDINE
EINECS -0
CAS No. 110529-22-1
Article Data7
CAS DataBase
Density 1.116 g/cm³
Solubility
Melting Point 66-72 °C
Formula C₁₈H₂₁NO
Boiling Point 406.8 °C at 760 mmHg
Molecular Weight 267.371
Flash Point 196.8 °C
Transport Information
Appearance white to slightly yellow crystalline powder
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Pyrrolidinemethanol,1-methyl-a,a-diphenyl-, (S)-;(+)-1-Methyl-2-(diphenylhydroxymethyl)pyrrolidine;(2S)-1-Methyl-a,a-diphenyl-2-pyrrolidinemethanol;(S)-(1-Methyl-2-pyrrolidinyl)diphenylmethanol;
PSA 23.47000
LogP 2.95460

alpha,alpha-Diphenyl-N-methyl-L-prolinol Specification

The IUPAC name of alpha,alpha-Diphenyl-N-methyl-L-prolinol is [(2S)-1-methylpyrrolidin-1-ium-2-yl]-diphenylmethanol. With the CAS registry number 110529-22-1, it is also named as 2-Pyrrolidinemethanol, 1-methyl-alpha,alpha-diphenyl-, (2S)-; 1,1,1-Diphenyl-(N-methyl-pyrroline-2yl)-methanol. The product's categories are asymmetric synthesis and synthetic organic chemistry. It is white to slightly yellow crystalline powder which should avoid direct sunshine.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 4.03; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Index of Refraction: 1.595; (7)Molar Refractivity: 81.39 cm³; (8)Molar Volume: 239.5 cm³; (9)Polarizability: 32.26×10^-24 cm³; (10)Surface Tension: 46.6 dyne/cm; (11)Enthalpy of Vaporization: 69.44 kJ/mol; (12)Vapour Pressure: 2.39E-07 mmHg at 25°C; (13)Rotatable Bond Count: 3; (14)Exact Mass: 268.170139; (15)MonoIsotopic Mass: 268.170139; (16)Topological Polar Surface Area: 24.7; (17)Heavy Atom Count: 20; (18)Formal Charge: 1; (19)Complexity: 287.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

People can use the following data to convert to the molecule structure.
1. SMILES: OC(c1ccccc1)(c2ccccc2)[C@H]3N(C)CCC3;
2. InChI: InChI=1/C18H21NO/c1-19-14-8-13-17(19)18(20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17,20H,8,13-14H2,1H3/t17-/m0/s1.

Product Name

(S)-(+)-2-[HYDROXY(DIPHENYL)METHYL]-1-METHYLPYRROLIDINE

alpha,alpha-Diphenyl-N-methyl-L-prolinol Specification

Related Products

Hot Products