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| CAS No.: | 56633-75-1 |
|---|---|
| Name: | (S)-2-(2-PYRROLIDINYL)ACETIC ACID |
| Article Data: | 7 |
| Molecular Structure: | |
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| Formula: | C6H11NO2 |
| Molecular Weight: | 129.159 |
| Synonyms: | L-(+)-Homoproline;a-L-Homoproline;(S)-Homoproline;(S)-2-Pyrrolidineacetic acid;2-Pyrrolidineaceticacid, (S)-; |
| Density: | 1.104 g/cm3 |
| Melting Point: | 173-175 °C(Solv: acetone (67-64-1); ethyl ether (60-29-7); methanol (67-56-1)) |
| Boiling Point: | 272.3 °C at 760 mmHg |
| Flash Point: | 118.5 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 49.33000 |
| LogP: | 0.54190 |
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- Total:28 Page 1 of 1 1
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Specification
The 2-Pyrrolidineaceticacid, (2S)- is an organic compound with the formula C6H11NO2. The systematic name of this chemical is (2S)-Pyrrolidin-2-ylacetic acid. With the CAS registry number 56633-75-1, it is also named as (S)-Homoproline. The category of the product is Pharmacetical. Besides, its molecular weight is 129.16.
The physical properties of 2-Pyrrolidineaceticacid, (2S)- are: (1)ACD/LogP: -0.24; (2)ACD/LogD (pH 5.5): -2.75; (3)ACD/LogD (pH 7.4): -2.74; (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: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 29.54 Å2; (12)Index of Refraction: 1.47; (13)Molar Refractivity: 32.68 cm3; (14)Molar Volume: 116.9 cm3; (15)Polarizability: 12.95×10-24 cm3; (16)Surface Tension: 42.6 dyne/cm; (17)Density: 1.104 g/cm3; (18)Flash Point: 118.5 °C; (19)Enthalpy of Vaporization: 56.2 kJ/mol; (20)Boiling Point: 272.3 °C at 760 mmHg; (21)Vapour Pressure: 0.0017 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. 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: O=C(O)C[C@H]1NCCC1
(2)InChI: InChI=1/C6H11NO2/c8-6(9)4-5-2-1-3-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1
(3)InChIKey: ADSALMJPJUKESW-YFKPBYRVBE
(4)Std. InChI: InChI=1S/C6H11NO2/c8-6(9)4-5-2-1-3-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1
(5)Std. InChIKey: ADSALMJPJUKESW-YFKPBYRVSA-N