3-Chloro-3-deoxy-D-glucose supplier

Name
3-Chloro-3-deoxy-D-glucose
EINECS
CAS No. 22933-89-7
Density 1.645 g/cm³
Solubility
Melting Point 140-144°C
Formula C₆H₁₁ClO₅
Boiling Point 473.715 °C at 760 mmHg
Molecular Weight 198.603
Flash Point 240.295 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Chlor-3-desoxy-D-glucose
PSA 90.15000
LogP -1.97490

3-Chloro-3-deoxy-D-glucose Specification

The systematic name of 3-Chloro-3-deoxy-D-glucose is (1S)-2-chloro-2-deoxyhexopyranose. With the CAS registry number 22933-89-7, it is also named as D-Glucose,3-chloro-3-deoxy-. The product's molecular formula is C₆H₁₁ClO₅ and its molecular weight is 198.60.

The other characteristics of 3-Chloro-3-deoxy-D-glucose can be summarized as: (1)ACD/LogP: -1.11; (2)# of Rule of 5 Violations: 0; (3)H bond acceptors: 5; (4)H bond donors: 4; (5)Freely Rotating Bonds: 5; (6)Polar Surface Area: 90.15 Å²; (7)Index of Refraction: 1.583; (8)Molar Refractivity: 40.383 cm³; (9)Molar Volume: 120.75 cm³; (10)Polarizability: 16.009×10^-24cm³; (11)Surface Tension: 77.106 dyne/cm; (12)Density: 1.645 g/cm³; (13)Flash Point: 240.295 °C; (14)Enthalpy of Vaporization: 84.947 kJ/mol; (15)Boiling Point: 473.715 °C at 760 mmHg; (16)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
SMILES:ClC1C(O)C(O)C(O[C@@H]1O)CO
InChI:InChI=1/C6H11ClO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2?,3?,4?,5?,6-/m0/s1
InChIKey:SNGNCYILSHZBLM-IHVYINHVBQ
Std. InChI:InChI=1S/C6H11ClO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2?,3?,4?,5?,6-/m0/s1
Std. InChIKey:SNGNCYILSHZBLM-IHVYINHVSA-N

Product Name

3-Chloro-3-deoxy-D-glucose

3-Chloro-3-deoxy-D-glucose Specification

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