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CAS No.: | 63234-71-9 |
---|---|
Name: | 1-Aminopyrrolidine hydrochloride |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C4H10N2.HCl |
Molecular Weight: | 122.598 |
Synonyms: | 1-Pyrrolidinamine,monohydrochloride (9CI);Pyrrolidine, 1-amino-, hydrochloride (7CI);1-Aminopyrrolidine hydrochloride;N-Aminopyrrolidine hydrochloride; |
EINECS: | 264-040-2 |
Melting Point: | 109-126 °C(lit.) |
Boiling Point: | 112.3 °C at 760 mmHg |
Flash Point: | 28.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 29.26000 |
LogP: | 1.39610 |
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The 1-Aminopyrrolidine hydrochloride is an organic compound with the formula . The IUPAC name of this chemical is din-1-amine hydrochloride. With the CAS registry number 63234-71-9, it is also named as Pyrrolidin-1-amine monohydrochloride. The product's categories are Building Blocks; Heterocyclic Building Blocks; Pyrrolidines.
Physical properties about 1-Aminopyrrolidine hydrochloride are: (1)ACD/LogP: -0.84; (2)ACD/LogD (pH 5.5): -3.45; (3)ACD/LogD (pH 7.4): -1.77; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 6.48 Å2; (12)Flash Point: 28.1 °C; (13)Enthalpy of Vaporization: 35.08 kJ/mol; (14)Boiling Point: 112.3 °C at 760 mmHg; (15)Vapour Pressure: 21.9 mmHg at 25°C.
Uses of 1-Aminopyrrolidine hydrochloride: it can be used to produce pyridin-4-ylmethylene-pyrrolidin-1-yl-amine by heating on a steam bath. It will need reagent pyridine-4-carbaldehyde and solvent ethanol with reaction time of 30 min. The yield is about 67%.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.NN1CCCC1
(2)InChI: InChI=1/C4H10N2.ClH/c5-6-3-1-2-4-6;/h1-5H2;1H
(3)InChIKey: KTVYGDJRKCXTRA-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C4H10N2.ClH/c5-6-3-1-2-4-6;/h1-5H2;1H
(5)Std. InChIKey: KTVYGDJRKCXTRA-UHFFFAOYSA-N