(S)-2-(Aminomethyl)-1-Cbz-pyrrolidine supplier

Name
(S)-2-(Aminomethyl)-1-Cbz-pyrrolidine
EINECS
CAS No. 119020-03-0
Article Data8
CAS DataBase
Density 1.155 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₈N₂O₂
Boiling Point 370.5 °C at 760 mmHg
Molecular Weight 234.298
Flash Point 177.9 °C
Transport Information
Appearance
Safety 26-36/37/39-39
Risk Codes 36/37/38-41-37/38-22
Molecular Structure
Hazard Symbols R36/37/38:;
Synonyms 1-Pyrrolidinecarboxylic acid, 2-(aminomethyl)-, phenylmethyl ester;2-(Aminomethyl)-1-pyrrolidinecarboxylic acid phenylmethyl ester;2-(Aminomethyl)pyrrolidine-1-carboxylic acid benzyl ester;
PSA 55.56000
LogP 2.38450

(S)-2-(Aminomethyl)-1-Cbz-pyrrolidine Specification

The 1-Pyrrolidinecarboxylicacid, 2-(aminomethyl)-, phenylmethyl ester, with the CAS registry number 119020-03-0, has the systematic name of benzyl 2-(aminomethyl)pyrrolidine-1-carboxylate. It belongs to the following product categories: Pyrrole & Pyrrolidine & Pyrroline. And the molecular formula of this chemical is C₁₃H₁₈N₂O₂.

The physical properties of 1-Pyrrolidinecarboxylicacid, 2-(aminomethyl)-, phenylmethyl ester are as followings: (1)ACD/LogP: 1.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.96; (4)ACD/LogD (pH 7.4): -1.29; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 32.78 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 65.68 cm³; (15)Molar Volume: 202.8 cm³; (16)Polarizability: 26.03×10^-24cm³; (17)Surface Tension: 48 dyne/cm; (18)Density: 1.155 g/cm³; (19)Flash Point: 177.9 °C; (20)Enthalpy of Vaporization: 61.74 kJ/mol; (21)Boiling Point: 370.5 °C at 760 mmHg; (22)Vapour Pressure: 1.1E-05 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N2C(CN)CCC2
(2)InChI: InChI=1/C13H18N2O2/c14-9-12-7-4-8-15(12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10,14H2
(3)InChIKey: NQGRCKNDDGCZPV-UHFFFAOYAX

Product Name

(S)-2-(Aminomethyl)-1-Cbz-pyrrolidine

(S)-2-(Aminomethyl)-1-Cbz-pyrrolidine Specification

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