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1-Propanol,2-(2-hydroxypropoxy)- (106-62-7)

Identification
Name:1-Propanol,2-(2-hydroxypropoxy)-
Synonyms:2-(2-Hydroxypropoxy)-1-propanol;
CAS:106-62-7
EINECS: 203-416-2
Molecular Formula: C6H14O3
Molecular Weight: 134.17
InChI: InChI=1/2C3H6.C2H6O2/c2*1-3-2;3-1-2-4/h2*3H,1H2,2H3;3-4H,1-2H2
Molecular Structure: (C6H14O3) 2-(2-Hydroxypropoxy)-1-propanol;
Properties
Flash Point: 95.5°C
Boiling Point: 234.2°Cat760mmHg
Density:1.034g/cm3
Solubility:Lower molecular weight members are sol in water
Infinite
In water: PPG 425, >10,000 mg/L; PPG 1000, >1,000 mg/L; PPG 2000, 250 mg/L; PPG 2700, 15 mg/L [West RJ et al; Environ Toxicol Chem 26: 862-71 (2007)] PubMed Abstract
Specification:

The CAS register number of 2-(2-Hydroxypropoxy)-1-propanol is 106-62-7. It also can be called as 1-Propanol,2-(2-hydroxypropoxy)- and the IUPAC name about this chemical is 2-(2-hydroxypropoxy)propan-1-ol. The molecular formula about this chemical is C6H14O3 and the molecular weight is 134.17.

Physical properties about 2-(2-Hydroxypropoxy)-1-propanol are: (1)ACD/LogP: -0.82; (2)ACD/LogD (pH 5.5): -0.82; (3)ACD/LogD (pH 7.4): -0.82; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 8.55; (7)ACD/KOC (pH 7.4): 8.55; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 27.69Å2; (12)Index of Refraction: 1.445; (13)Molar Refractivity: 34.57 cm3; (14)Molar Volume: 129.7 cm3; (15)Polarizability: 13.7x10-24cm3; (16)Surface Tension: 36.4 dyne/cm; (17)Enthalpy of Vaporization: 54.74 kJ/mol; (18)Boiling Point: 234.2 °C at 760 mmHg; (19)Vapour Pressure: 0.00984 mmHg at 25°C.

Uses of 2-(2-Hydroxypropoxy)-1-propanol: it can be used to produce 2,2'-Dichlorisopropyl-propylether at heating. This reaction will need reagent SOCl2 and solvent pyridine, CHCl3 with reaction time of 1 hours. The yield is about 63%.

You can still convert the following datas into molecular structure:
(1)SMILES: OCC(OCC(O)C)C
(2)InChI: InChI=1/C6H14O3/c1-5(8)4-9-6(2)3-7/h5-8H,3-4H2,1-2H3
(3)InChIKey: DUFKCOQISQKSAV-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C6H14O3/c1-5(8)4-9-6(2)3-7/h5-8H,3-4H2,1-2H3
(5)Std. InChIKey: DUFKCOQISQKSAV-UHFFFAOYSA-N

Flash Point: 95.5°C
Color: Clear, lightly colored, slightly oily, viscous liquids
Safety Data