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Name |
(3S)-1-(2-Aminoethyl)-3-pyrrolidinol |
EINECS | N/A |
CAS No. | 540787-75-5 | Density | 1.103 g/cm3 |
PSA | 49.49000 | LogP | -0.35010 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H14N2O | Boiling Point | 245.3 °C at 760 mmHg |
Molecular Weight | 130.19 | Flash Point | 102.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(3S)-1-(2-Aminoethyl)-3-pyrrolidine; |
Article Data | 4 |
The (3S)-1-(2-Aminoethyl)-3-pyrrolidinol, with the CAS registry number 540787-75-5, is also known as 3-Pyrrolidinol, 1-(2-aminoethyl)-, (3S)-. It belongs to the product categories of Aminetertiary; Pyrrolidine; Pharmacetical. This chemical's molecular formula is C6H14N2O and molecular weight is 130.110613. Its IUPAC name is called (3S)-1-(2-aminoethyl)pyrrolidin-3-ol.
Physical properties of (3S)-1-(2-Aminoethyl)-3-pyrrolidinol: (1)#H bond acceptors: 3; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 4; (4)Index of Refraction: 1.53; (5)Molar Refractivity: 36.46 cm3; (6)Molar Volume: 118 cm3; (7)Surface Tension: 48.6 dyne/cm; (8)Density: 1.103 g/cm3; (9)Flash Point: 102.1 °C; (10)Enthalpy of Vaporization: 56.05 kJ/mol; (11)Boiling Point: 245.3 °C at 760 mmHg; (12)Vapour Pressure: 0.00482 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(CC1O)CCN
(2)Isomeric SMILES: C1CN(C[C@H]1O)CCN
(3)InChI: InChI=1S/C6H14N2O/c7-2-4-8-3-1-6(9)5-8/h6,9H,1-5,7H2/t6-/m0/s1
(4)InChIKey: ZNLCTCNYKCENHP-LURJTMIESA-N