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| Name |
((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol |
EINECS | N/A |
| CAS No. | 55438-52-3 | Density | 1.179 g/cm3 |
| PSA | 32.26000 | LogP | 1.96410 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C11H14ClNO | Boiling Point | 345.1 °C at 760 mmHg |
| Molecular Weight | 211.69 | Flash Point | 162.5 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
3-pyrrolidinemethanol, 4-(4-chlorophenyl)-, (3S,4R)-; |
((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol Specification
The ((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol with the cas number 55438-52-3 is also called 3-pyrrolidinemethanol, 4-(4-chlorophenyl)-, (3S,4R)-. Its molecular formula is C11H14ClNO. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 32.26 Å2; (7)Index of Refraction: 1.552; (8)Molar Refractivity: 57.36 cm3; (9)Molar Volume: 179.4 cm3; (10)Polarizability: 22.74×10-24cm3; (11)Surface Tension: 44.4 dyne/cm; (12)Enthalpy of Vaporization: 62.17 kJ/mol; (13)Vapour Pressure: 2.4×10-5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1C2CNCC2CO)Cl
(2)InChI: InChI=1/C11H14ClNO/c12-10-3-1-8(2-4-10)11-6-13-5-9(11)7-14/h1-4,9,11,13-14H,5-7H2/t9-,11-/m0/s1
(3)InChIKey: CAPQIHOUMBRMTA-ONGXEEELBE
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