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| CAS No.: | 2483-65-0 |
|---|---|
| Name: | 3-AMINO-PYRROLIDIN-2-ONE |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C4H8N2O |
| Molecular Weight: | 100.12 |
| Synonyms: | 3-Amino-2-pyrrolidinone;3-aminopyrrolidin-2-one(SALTDATA: FREE);2-Pyrrolidinone, 3-aMino-;D,L-3-aMino-2-pyrrolidinone;3-Amino-2-oxopyrrolidine |
| Density: | 1.127 g/cm3 |
| Melting Point: | 106-108℃ |
| Boiling Point: | 305.589 °C at 760 mmHg |
| Flash Point: | 138.616 °C |
| Risk Codes: | 22 |
| PSA: | 55.12000 |
| LogP: | -0.13730 |
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- Total:33 Page 1 of 1 1
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Specification
The 3-Aminopyrrolidin-2-one, with CAS registry number 2483-65-0, has the systematic name of 3-aminopyrrolidin-2-one. Besides this, it is also called Butyro-1,4-lactam, 2-amino-. And the chemical formula of this chemical is C4H8N2O.
Physical properties of 3-Aminopyrrolidin-2-one: (1)ACD/LogP: -1.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4; (4)ACD/LogD (pH 7.4): -3; (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: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.12 Å2; (13)Index of Refraction: 1.486; (14)Molar Refractivity: 25.479 cm3; (15)Molar Volume: 88.818 cm3; (16)Polarizability: 10.1×10-24cm3; (17)Surface Tension: 38.802 dyne/cm; (18)Density: 1.127 g/cm3; (19)Flash Point: 138.616 °C; (20)Enthalpy of Vaporization: 54.604 kJ/mol; (21)Boiling Point: 305.589 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NCCC1N
(2)InChI: InChI=1/C4H8N2O/c5-3-1-2-6-4(3)7/h3H,1-2,5H2,(H,6,7)
(3)InChIKey: YNDAMDVOGKACTP-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C4H8N2O/c5-3-1-2-6-4(3)7/h3H,1-2,5H2,(H,6,7)
(5)Std. InChIKey: YNDAMDVOGKACTP-UHFFFAOYSA-N