(S)-1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose supplier

Name
BETA-CHLORALOSE
EINECS 240-429-2
CAS No. 16376-36-6
Article Data10
CAS DataBase
Density 1.773 g/cm³
Solubility
Melting Point 234-236 °C (dec.)(lit.)
Formula C₈H₁₁Cl₃O₆
Boiling Point 504.4 °C at 760 mmHg
Molecular Weight 309.531
Flash Point 258.9 °C
Transport Information 2811
Appearance
Safety 36
Risk Codes 20/21/22
Molecular Structure
Hazard Symbols Xn
Synonyms Chloralose,b- (8CI);alpha-D-Glucofuranose,1,2-O-(2,2,2-trichloroethylidene)-, (S)-;NSC52806;β-Chloralose;
PSA 88.38000
LogP -0.46290

(S)-1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose Specification

This chemical is called (S)-1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose, and its systematic name is 1,2-O-[(1S)-2,2,2-trichloroethylidene]-alpha-D-glucofuranose. With the molecular formula of C₈H₁₁Cl₃O₆, its molecular weight is 309.53. The CAS registry number of this chemical is 16376-36-6.

Other characteristics of the (S)-1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose can be summarised as followings: (1)ACD/LogP: 1.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.1; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 93.93; (8)ACD/KOC (pH 7.4): 93.93; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.38 Å²; (13)Index of Refraction: 1.586; (14)Molar Refractivity: 58.66 cm³; (15)Molar Volume: 174.5 cm³; (16)Polarizability: 23.25×10^-24cm³; (17)Surface Tension: 69.6 dyne/cm; (18)Density: 1.773 g/cm³; (19)Flash Point: 258.9 °C; (20)Enthalpy of Vaporization: 89.11 kJ/mol; (21)Boiling Point: 504.4 °C at 760 mmHg; (22)Vapour Pressure: 2.75E-12 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is harmful by inhalation, in contacting with skin and if swallowed. Wear suitable protective clothing if you use it.

You can still convert the following datas into molecular structure:
1.SMILES: ClC(Cl)(Cl)[C@H]1O[C@@H]2[C@@H](O)[C@H](O[C@@H]2O1)[C@H](O)CO
2.InChI: InChI=1/C8H11Cl3O6/c9-8(10,11)7-16-5-3(14)4(2(13)1-12)15-6(5)17-7/h2-7,12-14H,1H2/t2-,3+,4-,5-,6-,7+/m1/s1
3.InChIKey: OJYGBLRPYBAHRT-GVUNPQSCBW

Product Name

BETA-CHLORALOSE

(S)-1,2-O-(2,2,2-Trichloroethylidene)-alpha-D-glucofuranose Specification

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