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Name |
(2R,3S,4R,5S)-4-azido-2,3,5,6-tetrahydroxy-hexanal |
EINECS | N/A |
CAS No. | 20379-59-3 | Density | N/A |
PSA | 139.90000 | LogP | -2.45064 |
Solubility | N/A | Melting Point |
60-65 °C(lit.) |
Formula | C6H11N3O5 | Boiling Point | N/A |
Molecular Weight | 205.17 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | 22-24/25 | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
beta-D-Glucopyranosyl azide;4-Azido-4-deoxy-beta-D-glucose;4-Azido-4-deoxyglucose; |
Article Data | 2 |
The CAS register number of (2R,3S,4R,5S)-4-azido-2,3,5,6-tetrahydroxy-hexanal is 20379-59-3. It also can be called as 4-Azido-4-deoxy-beta-D-glucose and the IUPAC name about this chemical is (2R,3S,4R,5S)-4-azido-2,3,5,6-tetrahydroxyhexanal. The molecular formula about this chemical is C6H11N3O5 and the molecular weight is 205.17. It belongs to the following product categories which include Carbohydrate Synthesis; Click Chemistry; MonosaccharidesChemical Ligation; Organic Azides; Specialty Synthesis; Carbohydrates and so on. When you are using it, please do not breathe dust and avoid contact with skin and eyes.
Physical properties about (2R,3S,4R,5S)-4-azido-2,3,5,6-tetrahydroxy-hexanal are: (1)ACD/LogP: -1.17; (2)ACD/LogD (pH 5.5): -1.17; (3)ACD/LogD (pH 7.4): -1.17; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.51; (7)ACD/KOC (pH 7.4): 5.51; (8)#H bond acceptors: 8; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 10; (11)Polar Surface Area: 66.35Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [N-]=[N+]=N\[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)CO
(2)InChI: InChI=1/C6H11N3O5/c7-9-8-5(3(12)1-10)6(14)4(13)2-11/h2-6,10,12-14H,1H2/t3-,4+,5-,6-/m1/s1
(3)InChIKey: QJDMQMIMGQKBTN-JGWLITMVBR
(4)Std. InChI: InChI=1S/C6H11N3O5/c7-9-8-5(3(12)1-10)6(14)4(13)2-11/h2-6,10,12-14H,1H2/t3-,4+,5-,6-/m1/s1
(5)Std. InChIKey: QJDMQMIMGQKBTN-JGWLITMVSA-N