CAS No.4787-77-3,2-(1-PYRROLIDINO)PHENOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	4787-77-3
Name:	2-(1-PYRROLIDINO)PHENOL
Article Data:	5

Formula:	C₁₀H₁₃NO
Molecular Weight:	163.219
Synonyms:	Phenol,o-1-pyrrolidinyl- (6CI,7CI,8CI);2-(1-Pyrrolidinyl)phenol;2-Pyrrolidinophenol;
Density:	1.146 g/cm³
Melting Point:	108-112 °C
Boiling Point:	279.1 °C at 760 mmHg
Flash Point:	139.6 °C
Solubility:	Insoluble in water.
Appearance:	beige to brown crystalline powder
Hazard Symbols:	Xn
Risk Codes:	36/37/38-20/21/22
Safety:	36/37/39-26
PSA:	23.47000
LogP:	2.05740

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Specification

The Phenol,2-(1-pyrrolidinyl)- is an organic compound with the formula C₁₀H₁₃NO. The IUPAC name of this chemical is 2-pyrrolidin-1-ylphenol. With the CAS registry number 4787-77-3, it is also named as 1-(2-Hydroxyphenyl)pyrrolidine. The product's category is Phenyls & Phenyl-Het. Besides, it should be stored in a dark cool and well-ventilated place.

Physical properties about Phenol,2-(1-pyrrolidinyl)- are: (1)ACD/LogP: 1.68; (2)ACD/LogD (pH 5.5): 0.67; (3)ACD/LogD (pH 7.4): 1.61; (4)ACD/BCF (pH 5.5): 1.09; (5)ACD/BCF (pH 7.4): 9.55; (6)ACD/KOC (pH 5.5): 19.1; (7)ACD/KOC (pH 7.4): 167.61; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 12.47 Å²; (12)Index of Refraction: 1.594; (13)Molar Refractivity: 48.33 cm³; (14)Molar Volume: 142.3 cm³; (15)Polarizability: 19.16×10^-24cm³; (16)Surface Tension: 48.5 dyne/cm; (17)Density: 1.146 g/cm³; (18)Flash Point: 139.6 °C; (19)Enthalpy of Vaporization: 53.85 kJ/mol; (20)Boiling Point: 279.1 °C at 760 mmHg; (21)Vapour Pressure: 0.00242 mmHg at 25°C.

Preparation of Phenol,2-(1-pyrrolidinyl)-: this chemical can be prepared by tetrahydrofuran and 2-amino-phenol. This reaction will need catalyst TiO₂. The reaction temperature is 250 - 300 °C.

Phenol,2-(1-pyrrolidinyl)- can be prepared by tetrahydrofuran and 2-amino-phenol

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccccc1N2CCCC2
(2)InChI: InChI=1/C10H13NO/c12-10-6-2-1-5-9(10)11-7-3-4-8-11/h1-2,5-6,12H,3-4,7-8H2
(3)InChIKey: ZGSBDRFDXWRZAE-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C10H13NO/c12-10-6-2-1-5-9(10)11-7-3-4-8-11/h1-2,5-6,12H,3-4,7-8H2
(5)Std. InChIKey: ZGSBDRFDXWRZAE-UHFFFAOYSA-N