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CAS No.: | 23701-87-3 |
---|---|
Name: | Methyl 6-azido-6-deoxy-alpha-D-glucopyranoside |
Article Data: | 20 |
Molecular Structure: | |
Formula: | C7H13N3O5 |
Molecular Weight: | 219.197 |
Synonyms: | Glucopyranoside,methyl 6-azido-6-deoxy-, a-D- (6CI,8CI); |
Melting Point: | 102-104 °C |
PSA: | 128.90000 |
LogP: | -1.79654 |
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This chemical is called Methyl 6-azido-6-deoxy-alpha-D-glucopyranoside, and it can also be named as α-D-glucopyranoside, methyl 6-azido-6-deoxy-. With the molecular formula of C7H13N3O5, its molecular weight is 219.20. The CAS registry number of this chemical is 23701-87-3.
Other characteristics of the Methyl 6-azido-6-deoxy-alpha-D-glucopyranoside can be summarised as followings: (1)ACD/LogP: -0.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 26; (8)ACD/KOC (pH 7.4): 26; (9)#H bond acceptors: 8; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 91.51 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: [N-]=[N+]=N\C[C@H]1O[C@H](OC)[C@H](O)[C@@H](O)[C@@H]1O
2.InChI: InChI=1/C7H13N3O5/c1-14-7-6(13)5(12)4(11)3(15-7)2-9-10-8/h3-7,11-13H,2H2,1H3/t3-,4-,5+,6-,7+/m1/s1
3.InChIKey: DITZTAYZVSZBCC-ZFYZTMLRBM