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Name |
Hexitol,2,5-anhydro-3,4-dideoxy- |
EINECS | 203-239-0 |
CAS No. | 104-80-3 | Density | 1.13 g/cm3 |
PSA | 49.69000 | LogP | -0.48140 |
Solubility | N/A | Melting Point |
<-50℃ |
Formula | C6H12O3 | Boiling Point | 261.6 °C at 760 mmHg |
Molecular Weight | 132.159 | Flash Point | 112 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2,5-Furandimethanol,tetrahydro- (6CI,7CI,8CI);2,5-Anhydro-3,4-dideoxyhexitol;2,5-Bis[hydroxymethyl]tetrahydrofuran;NSC 40741;Tetrahydro-2,5-furandimethanol;2,5-Dihydroxymethyltetrahydrofuran; |
Article Data | 79 |
The Hexitol,2,5-anhydro-3,4-dideoxy-, with the CAS registry number 104-80-3, is also known as 2,5-Dihydroxymethyltetrahydrofuran. It belongs to the product categories of Heterocycles series; Detergents; Aldehydes; Intermediates & Fine Chemicals; Mutagenes is Research Chemicals; Pharmaceuticals. Its EINECS registry number is 203-239-0. This chemical's molecular formula is C6H12O3 and molecular weight is 132.16. What's more, both its IUPAC name and systematic name are the same which is called [5-(Hydroxymethyl)tetrahydrofuran-2-yl]methanol.
Physical properties about Hexitol,2,5-anhydro-3,4-dideoxy- are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 49.69 Å2; (6)Index of Refraction: 1.468; (7)Molar Refractivity: 32.5 cm3; (8)Molar Volume: 116.9 cm3; (9)Polarizability: 12.88×10-24 cm3; (10)Surface Tension: 47.5 dyne/cm; (11)Density: 1.13 g/cm3; (12)Flash Point: 112 °C; (13)Enthalpy of Vaporization: 58 kJ/mol; (14)Boiling Point: 261.6 °C at 760 mmHg; (15)Vapour Pressure: 0.00163 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes. As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: OCC1CCC(CO)O1
(2)InChI: InChI=1/C6H12O3/c7-3-5-1-2-6(4-8)9-5/h5-8H,1-4H2
(3)InChIKey: YCZZQSFWHFBKMU-UHFFFAOYAD