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Cas Database |
| Name |
(S)-1-Boc-3-hydroxymethylpyrrolidine |
EINECS | N/A |
| CAS No. | 199174-24-8 | Density | 1.084 g/cm3 |
| PSA | 49.77000 | LogP | 1.17360 |
| Solubility | Slightly soluble in water. | Melting Point |
N/A |
| Formula | C10H19NO3 | Boiling Point | 289.5 °C at 760 mmHg |
| Molecular Weight | 201.266 | Flash Point | 128.9 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
(S)-1-tert-Butoxycarbonylpyrrolidine-3-methanol;(3S)-3-Hydroxymethylpyrrolidine-1-carboxylic acid tert-butyl ester;1,1-Dimethylethyl(3S)-3-(hydroxymethyl)-1-pyrrolidinecarboxylate;(S)-N-Boc-(S)-pyrrolidine-3-methanol;1-Pyrrolidinecarboxylicacid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (S)-;tert-Butyl (3S)-3-(hydroxymethyl)pyrrolidine-1-carboxylate; |
Article Data | 13 |
(S)-1-Boc-3-hydroxymethylpyrrolidine Chemical Properties
IUPAC Name: tert-Butyl (3S)-3-(hydroxymethyl)pyrrolidine-1-carboxylate
Synonyms of : (S)-3-Hydroxymethylpyrrolidine-1-carboxylic acid tert-butyl ester
CAS NO: 199174-24-8
Molecular Formula: C10H19NO3
Molecular Weight: 201.26
Molecular Structure: 
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 4
Polar Surface Area: 38.77 Å2
Index of Refraction: 1.483
Molar Refractivity: 53.05 cm3
Molar Volume: 185.5 cm3
Surface Tension: 39.1 dyne/cm
Density: 1.084 g/cm3
Flash Point: 128.9 °C
Enthalpy of Vaporization: 61.36 kJ/mol
Boiling Point: 289.5 °C at 760 mmHg
Vapour Pressure: 0.000241 mmHg at 25°C
SMILES: O=C(OC(C)(C)C)N1C[C@H](CC1)CO
InChI: InChI=1/C10H19NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1
InChIKey: HKIGXXRMJFUUKV-QMMMGPOBBN
Std. InChI: InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1
Std. InChIKey: HKIGXXRMJFUUKV-QMMMGPOBSA-N
Product Categories: pharmacetical
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