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

Name
(S)-3-N-CBZ-AMINOPYRROLIDINE
EINECS
CAS No. 176970-12-0
Article Data2
CAS DataBase
Density 1.16g/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, 3-pyrrolidinyl-, phenylmethyl ester, (S)-;(S)-3-Benzyloxycarbonylaminopyrrolidine;
PSA 50.36000
LogP 1.99440

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

The cas register number of (S)-3-N-Cbz-aminopyrrolidine is 176970-12-0. It also can be called as Carbamic acid,(3S)-3-pyrrolidinyl-, phenylmethyl ester (9CI) and the Systematic name about this chemical is benzyl N-[(3S)-pyrrolidin-3-yl]carbamate.

Physical properties about (S)-3-N-Cbz-aminopyrrolidine are: (1)ACD/LogP: 1.54; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 50.36Å²; (6)Index of Refraction: 1.564; (7)Molar Refractivity: 61.63 cm³; (8)Molar Volume: 189.3 cm³; (9)Polarizability: 24.43X10^-24cm³; (10)Surface Tension: 46.5 dyne/cm; (11)Flash Point: 185.1 °C; (12)Enthalpy of Vaporization: 63.09 kJ/mol; (13)Boiling Point: 382.5 °C at 760 mmHg; (14)Vapour Pressure: 4.69E-06 mmHg at 25°C.

You can still convert the following datas into 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-/m0/s1
(3)InChIKey: DSOICHFMGRBFCM-NSHDSACABZ
(4)Std. InChI: InChI=1S/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-/m0/s1
(5)Std. InChIKey: DSOICHFMGRBFCM-NSHDSACASA-N

Product Name

(S)-3-N-CBZ-AMINOPYRROLIDINE

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

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