Cas no 6972-98-1 (Glucopyranoside,methyl 4,6-O-ethylidene-, di-p-toluenesulfonate, a-D- (8CI))
6972-98-1 structure
Product Name:Glucopyranoside,methyl 4,6-O-ethylidene-, di-p-toluenesulfonate, a-D- (8CI)
CAS No:6972-98-1
MF:C23H28O10S2
MW:528.592425346375
CID:528356
PubChem ID:247539
Update Time:2025-04-19
Glucopyranoside,methyl 4,6-O-ethylidene-, di-p-toluenesulfonate, a-D- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- Glucopyranoside,methyl 4,6-O-ethylidene-, di-p-toluenesulfonate, a-D- (8CI)
- [6-methoxy-2-methyl-7-(4-methylphenyl)sulfonyloxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] 4-methylbenzenesulfonate
- 6972-98-1
- NSC62396
- DTXSID40289615
- methyl 4,6-o-ethylidene-2,3-bis-o-[(4-methylphenyl)sulfonyl]hexopyranoside
- NSC-62396
-
- Inchi: 1S/C23H28O10S2/c1-14-5-9-17(10-6-14)34(24,25)32-21-20-19(13-29-16(3)30-20)31-23(28-4)22(21)33-35(26,27)18-11-7-15(2)8-12-18/h5-12,16,19-23H,13H2,1-4H3
- InChI Key: QZCKYCZXJBERIW-UHFFFAOYSA-N
- SMILES: S(C1C=CC(C)=CC=1)(=O)(=O)OC1C(C(OC)OC2COC(C)OC12)OS(C1C=CC(C)=CC=1)(=O)=O
Computed Properties
- Exact Mass: 528.11244
- Monoisotopic Mass: 528.11238943g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 35
- Rotatable Bond Count: 7
- Complexity: 896
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 6
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 140?2
Experimental Properties
- PSA: 123.66
Glucopyranoside,methyl 4,6-O-ethylidene-, di-p-toluenesulfonate, a-D- (8CI) Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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