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Basic Information |
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| Name |
Pyrrolidine-3-carboxylic acid hydrochloride |
EINECS | 200-258-5 |
| CAS No. | 953079-94-2 | Density | N/A |
| PSA | 49.33000 | LogP | 0.81130 |
| Solubility | N/A | Melting Point |
33-38℃ |
| Formula | C5H10ClNO2 | Boiling Point | 282.4 °C at 760 mmHg |
| Molecular Weight | 151.593 | Flash Point | 124.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 26-39 | Risk Codes | 41 |
| Molecular Structure |
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Hazard Symbols |
 Xi
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| Synonyms |
beta-Proline hydrochloride; |
Pyrrolidine-3-carboxylic acid hydrochloride Specification
The systematic name of this chemical is pyrrolidine-3-carboxylic acid hydrochloride. With the CAS registry number 953079-94-2, it is also named as 3-Pyrrolidinecarboxylic acid, hydrochloride (1:1). The formula is C5H10ClNO2 and the molecular weight is 151.59.
The other characteristics of Pyrrolidine-3-carboxylic acid hydrochloride can be summarized as: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 49.33 Å2; (6)Flash Point: 124.6 °C; (7)Enthalpy of Vaporization: 57.36 kJ/mol; (8)Boiling Point: 282.4 °C at 760 mmHg; (9)Vapour Pressure: 0.000885 mmHg at 25°C.
People can use the following data to convert to the molecule structure.
1. SMILES:Cl.OC(=O)C1CNCC1;
2. InChI=1/C5H9NO2.ClH/c7-5(8)4-1-2-6-3-4;/h4,6H,1-3H2,(H,7,8);1H
3. InChIKey:OYCLYMMIZJWYJG-UHFFFAOYAX
4. Std. InChI:InChI=1S/C5H9NO2.ClH/c7-5(8)4-1-2-6-3-4;/h4,6H,1-3H2,(H,7,8);1H
5. Std. InChIKey:OYCLYMMIZJWYJG-UHFFFAOYSA-N
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