3-Pyrrolidinol,3-phenyl- supplier

Name
3-phenylpyrrolidin-3-ol
EINECS 256-495-0
CAS No. 49798-31-4
Article Data8
CAS DataBase
Density 1.13 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₃NO
Boiling Point 282.7 °C at 760 mmHg
Molecular Weight 163.219
Flash Point 122.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Phenyl-3-hydroxypyrrolidine;3-Phenyl-3-pyrrolidinol;
PSA 32.26000
LogP 1.19630

3-Pyrrolidinol,3-phenyl- Specification

The 3-Pyrrolidinol,3-phenyl-, with the CAS registry number 49798-31-4, is also known as 3-Phenyl-pyrrolidin-3-ol. Its EINECS registry number is 256-495-0. This chemical's molecular formula is C₁₀H₁₃NO and molecular weight is 163.21632. What's more, both its IUPAC name and systematic name are the same which is called 3-Phenylpyrrolidin-3-ol.

Physical properties about 3-Pyrrolidinol,3-phenyl- are: (1)ACD/LogP: 0.34; (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: 1.575; (8)Molar Refractivity: 47.73 cm³; (9)Molar Volume: 144.3 cm³; (10)Surface Tension: 46.7 dyne/cm; (11)Density: 1.13 g/cm³; (12)Flash Point: 122.8 °C; (13)Enthalpy of Vaporization: 55.09 kJ/mol; (14)Boiling Point: 282.7 °C at 760 mmHg; (15)Vapour Pressure: 0.00156 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC2(c1ccccc1)CCNC2
(2) InChI: InChI=1/C10H13NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h1-5,11-12H,6-8H2
(3) InChIKey: AFQYBBFSDHKQJV-UHFFFAOYAZ

Product Name

3-phenylpyrrolidin-3-ol

3-Pyrrolidinol,3-phenyl- Specification

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