(R)-3-N-Cbz-aminopyrrolidine supplier

Name
(R)-3-N-CBZ-AMINOPYRROLIDINE
EINECS
CAS No. 879275-77-1
Article Data4
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₆N₂O₂
Boiling Point 382.5 °C at 760 mmHg
Molecular Weight 220.271
Flash Point 185.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbamicacid, (3R)-3-pyrrolidinyl-, phenylmethyl ester (9CI);
PSA 50.36000
LogP 1.99440

(R)-3-N-Cbz-aminopyrrolidine Specification

The (R)-3-N-Cbz-aminopyrrolidine, with the CAS registry number 879275-77-1, has the systematic name of benzyl N-[(3R)-pyrrolidin-3-yl]carbamate. It is a kind of organics, and should be stored at dry and cool environment. And the molecular formula of the chemical is C₁₂H₁₆N₂O₂.

The characteristics of (R)-3-N-Cbz-aminopyrrolidine are as followings: (1)ACD/LogP: 1.54; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 50.36 Å²; (7)Index of Refraction: 1.564; (8)Molar Refractivity: 61.63 cm³; (9)Molar Volume: 189.3 cm³; (10)Polarizability: 24.43×10^-24cm³; (11)Surface Tension: 46.5 dyne/cm; (12)Density: 1.16 g/cm³; (13)Flash Point: 185.1 °C; (14)Enthalpy of Vaporization: 63.09 kJ/mol; (15)Boiling Point: 382.5 °C at 760 mmHg; (16)Vapour Pressure: 4.69E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N[C@@H]2CCNC2
(2)InChI: InChI=1/C12H16N2O2/c15-12(14-11-6-7-13-8-11)16-9-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2,(H,14,15)/t11-/m1/s1
(3)InChIKey: DSOICHFMGRBFCM-LLVKDONJBI

Product Name

(R)-3-N-CBZ-AMINOPYRROLIDINE

(R)-3-N-Cbz-aminopyrrolidine Specification

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