((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol supplier

Name
((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol
EINECS
CAS No. 55438-52-3
Density 1.179 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄ClNO
Boiling Point 345.1 °C at 760 mmHg
Molecular Weight 211.69
Flash Point 162.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-pyrrolidinemethanol, 4-(4-chlorophenyl)-, (3S,4R)-;
PSA 32.26000
LogP 1.96410

((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

Product Name

((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol

((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol Specification

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