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3-Furanmethanol,tetrahydro- (15833-61-1)

Identification
Name:3-Furanmethanol,tetrahydro-
Synonyms:(3-Oxolanyl)methanol;3-Hydroxymethyltetrahydrofuran;
CAS:15833-61-1
Molecular Formula: C5H10O2
Molecular Weight: 102.13
InChI: InChI=1/C5H10O2/c6-3-5-1-2-7-4-5/h5-6H,1-4H2
Molecular Structure: (C5H10O2) (3-Oxolanyl)methanol;3-Hydroxymethyltetrahydrofuran;
Properties
Flash Point: 97.8°C
Density:1.456
Refractive index:1.061
Specification:

The IUPAC name of Tetrahydro-3-furanmethanol is oxolan-3-ylmethanol. With the CAS registry number 15833-61-1, it is also named as 3-furanmethanol, tetrahydro-. The product's categories are API intermediates; building blocks; furans; heterocyclic building blocks. Additionally, this chemical should be sealed in the container and stored in the cool and dry place.   

The other characteristics of this product can be summarized as: (1)ACD/LogP: -0.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.72; (4)ACD/LogD (pH 7.4): -0.72; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 9.68; (8)ACD/KOC (pH 7.4): 9.68; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.447; (13)Molar Refractivity: 26.28 cm3; (14)Molar Volume: 98.3 cm3; (15)Polarizability: 10.41×10-24 cm3; (16)Surface Tension: 39 dyne/cm; (17)Enthalpy of Vaporization: 50.59 kJ/mol; (18)Vapour Pressure: 0.0899 mmHg at 25°C; (19)Rotatable Bond Count: 1; (20)Exact Mass: 102.06808; (21)MonoIsotopic Mass: 102.06808; (22)Topological Polar Surface Area: 29.5; (23)Heavy Atom Count: 7; (24)Complexity: 54.

Uses of Tetrahydro-3-furanmethanol: It can react with arachidonyl chloride to get (+/-)-tetrahydrofur-3-ylmethyl (5Z,8Z,11Z,14Z)-eicosa-5,8,11,14-tetraenoate. This reaction needs solvent CH2Cl2 at temperature of 20 °C.

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

People can use the following data to convert to the molecule structure.
1. Canonical SMILES: C1COCC1CO
2. InChI: InChI=1S/C5H10O2/c6-3-5-1-2-7-4-5/h5-6H,1-4H2
3. InChIKey: PCPUMGYALMOCHF-UHFFFAOYSA-N

Flash Point: 97.8°C
Safety Data
Hazard Symbols Xi:Irritant