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CAS No.: | 110013-18-8 |
---|---|
Name: | (R)-Pyrrolidin-3-ylmethanol |
Article Data: | 27 |
Molecular Structure: | |
Formula: | C5H11NO |
Molecular Weight: | 101.148 |
Synonyms: | 3-Pyrrolidinemethanol,(R)-;(R)-3-Pyrrolidinemethanol;(R)-Pyrrolidin-3-ylmethanol; |
Density: | 0.978 g/cm3 |
Boiling Point: | 176.1 °C at 760 mmHg |
Flash Point: | 89.6 °C |
Solubility: | Slightly soluble in water. |
Hazard Symbols: | F,C |
Risk Codes: | 36/37/38 |
Safety: | 26-37-60 |
PSA: | 32.26000 |
LogP: | -0.08300 |
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This chemical is called (R)-Pyrrolidin-3-ylmethanol, and it can also be named as 3-Pyrrolidinemethanol, (3R)-. With the molecular formula of C5H11NO, its molecular weight is 101.15. The CAS registry number of this chemical is 110013-18-8.
Other characteristics of the (R)-Pyrrolidin-3-ylmethanol can be summarised as followings: (1)ACD/LogP: -0.85; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.454; (8)Molar Refractivity: 28.02 cm3; (9)Molar Volume: 103.3 cm3; (10)Polarizability: 11.1×10-24cm3; (11)Surface Tension: 36.5 dyne/cm; (12)Density: 0.978 g/cm3; (13)Flash Point: 89.6 °C; (14)Enthalpy of Vaporization: 48.02 kJ/mol; (15)Boiling Point: 176.1 °C at 760 mmHg; (16)Vapour Pressure: 0.339 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: OC[C@H]1CNCC1
2.InChI: InChI=1/C5H11NO/c7-4-5-1-2-6-3-5/h5-7H,1-4H2/t5-/m1/s1
3.InChIKey: QOTUIIJRVXKSJU-RXMQYKEDBZ